job.id 457 job.name {3D WY-3 cubic amorphous init velocity-NVT 0.2.fs, 2000 to sphere, from job 441} job.description { } job.status finished job.submitted {2025-01-05 16:09:15} job.started {2025-01-05 16:09:16} job.finished {2025-01-06 23:18:17} job.queue 7 job.errormsg {} job.pid 0 job.userid 1 job.priority 5 job.jobserverid 2 data.joboptions {_protocol_type_ JobControl _description_ {} passwd {} _name_ {} nproc 1 priority 5 _protocol_id_ 0 _protocol_pid_ 0 _version_ 1.1 context {} user user} data.script {# # Basic script for running batch jobs # package require logger package require MD::Stage package require MD::TaskManager package require MD.Results package require memory package require MD::Workspace package require jobcontrol package require JobOptions package require base64 package require md5 proc task {args} {} namespace eval ::MD {} logger::setlevel notice set gLog [logger::init MD] ::logger::import -all -prefix "log_" -namespace ::MD MD # # Get the version of the Jobs database in use # set JobDBVersion [join [db "SELECT value FROM info WHERE item ='Version'"]] # If we want to start child jobs, we need a jobcontrol object, on the localhost Jobcontrol::JobcontrolProxy ::jobcontrol # # The workspace # set tmp [join [lindex [db "SELECT value FROM data WHERE job = $::job::id AND item = 'workspace'"] 0]] ::MD::Workspace ::workspace ::workspace fromString $tmp # # Any input files? # set lfiles "" if {[catch { set lfiles [join [db "SELECT value FROM data WHERE job = $::job::id AND item = 'input_file'"]] } err_msg]} { error "Failed while getting input files:\n $err_msg" } set linput_files "" foreach elem $lfiles { set fname [file join [pwd] [lindex $elem 0]] set stage_id [lindex $elem 1] set fdata [lindex $elem 2] # See if this is base64 encoded if {![catch {set decode64_data [::base64::decode $fdata]}]} { # Succesfully decoded from base64 set fdata $decode64_data unset decode64_data } if {[catch { set fd [open $fname "w"] fconfigure $fd -encoding binary -translation binary puts -nonewline $fd $fdata close $fd } err_msg]} { error "Failed to write Job input file $fname:\n $err_msg" } unset fdata lappend linput_files [list $stage_id $fname] } # # Get info about this job # if {$JobDBVersion < 3.0} { set jdata [join [db "SELECT name, queue, userid, priority, jobserverid FROM job WHERE id = $::job::id"]] set ::job::name [lindex $jdata 0] set ::job::queueid [lindex $jdata 1] set ::job::userid [lindex $jdata 2] set ::job::priority [lindex $jdata 3] set ::job::parent 0 } else { set jdata [join [db "SELECT name, queue, userid, priority, jobserverid, parent FROM job WHERE id = $::job::id"]] set ::job::name [lindex $jdata 0] set ::job::queueid [lindex $jdata 1] set ::job::userid [lindex $jdata 2] set ::job::priority [lindex $jdata 3] set ::job::parent [lindex $jdata 5] } set ::job::username "" set ::job::queue "" if {[string is integer -strict $::job::userid]} { # Get the username from the user id if {[catch {set ::job::username [join [db "SELECT name FROM user WHERE id = $::job::userid"]]}]} { set ::job::username [join [db "SELECT name FROM \[user\] WHERE id = $::job::userid"]] } } if {[string is integer -strict $::job::queueid]} { # Get the queue name from the queue id set ::job::queue [join [join [db "SELECT name FROM queue WHERE id = $::job::queueid"]]] } # # Get the nproc option in order to pass it along to subjobs if any # set ::job::nproc 1 set tmp [join [lindex [db "SELECT value FROM data WHERE job = $::job::id AND item = 'joboptions'"] 0]] foreach {opt_name opt_value} $tmp { if {$opt_name == "nproc"} { set ::job::nproc $opt_value } } # # Set up information about the job in the workspace # ::workspace eval namespace eval ::job [list set id $::job::id] ::workspace eval [list set ::job::parent $::job::parent] ::workspace eval [list set ::job::serverId [info hostname]] ::workspace eval [list set ::job::dir [pwd]] ::workspace eval [list set ::job::name [join $::job::name "_"]] ::workspace eval [list set ::job::queueid $::job::queueid] ::workspace eval [list set ::job::queue $::job::queue] ::workspace eval [list set ::job::userid $::job::userid] ::workspace eval [list set ::job::username $::job::username] ::workspace eval [list set ::job::priority $::job::priority] ::workspace eval [list set ::job::nproc $::job::nproc] # Prepare a list of command to execute from the calling job. ::workspace eval [::list set ::subjob_commands ""] # # And forcefield, if required # set ff_local [join [db "SELECT value FROM data WHERE job = $::job::id AND item = 'forcefield_local'"]] if {[::workspace eval {info exists __fffile}]} { package require MD::FF ::MD::FF ::FF ::FF configure -silent 1 catch { if {$ff_local != ""} { # Load a local forcefield set fname [join [db "SELECT value FROM data WHERE job = $::job::id AND item = 'forcefield_file'"]] if {[string range $fname 0 0] == "\{"} { set fname [join $fname] } set fdata [join [db "SELECT value FROM data WHERE job = $::job::id AND item = 'forcefield_content'"]] if {[string range $fdata 0 0] == "\{"} { set fdata [join $fdata] } # See if this is base64 encoded if {![catch {set decode64_data [::base64::decode $fdata]}]} { # Succesfully decoded from base64 set fdata $decode64_data unset decode64_data } set fd [open $fname "w"] puts -nonewline $fd $fdata close $fd ::FF readFF [file join [pwd] $fname] ::FF configure -forcefield $ff_local # Update the workspace for sub-jobs if any ::workspace eval [list set __fffile [::FF fffile]] ::workspace eval [list set __ff $ff_local] } else { # Setup a forcefield from Forcefield.kit set __fffile [::workspace eval {set __fffile}] ::FF readFF $__fffile set __ff [::workspace eval {set __ff}] ::FF configure -forcefield $__ff } set ::FF ::FF set fdata "" # On old JS the ff_file_content might not be available catch {set fdata [::FF ff_file_content]} if {$fdata != ""} { set ffmd5 [::md5::md5 -hex $fdata] unset fdata set cur_ff [::FF cget -forcefield] set cur_file [::FF fffile] puts "\nForcefield set to: $cur_ff\n File: $cur_file \t md5 sum: $ffmd5\n" } } } # # The stages, ignoring everything else like the flowchart # set ok 0 set tmp [join [lindex [db "SELECT value FROM data WHERE job = $::job::id AND LOWER(item) = 'flowchart'"] 0]] if {[string length $tmp] > 2} { foreach {item data} $tmp { switch $item { "StageHandler" { ::MD::Stage::Handler stageHandler -workspace ::workspace stageHandler fromString $data set ok 1 } } } } else { # No flowchart, but maybe a stagehandler... set data [join [lindex [db "SELECT value FROM data WHERE job = $::job::id AND LOWER(item) = 'stagehandler'"] 0]] if {[string length $data] > 2} { ::MD::Stage::Handler stageHandler -workspace ::workspace stageHandler fromString $data set ok 1 } } unset -nocomplain tmp if {!$ok} { error "Could not find the stage information!" } # # Other tools that we need # ::MD::TaskManager taskmanager if {[file exists Job.xml]} { file delete -force Job.xml } ::MD::Results::Handler Results -file Job.xml # # Finally, do the real work # set stage [stageHandler getInitialStage] $stage configure -workspace ::workspace -workingdirectory [pwd] $stage run 0 # # And save any unsaved results # Results save # # Write down the final workspace if this job was started by another # if {$::job::parent > 0} { set fd [open "final_workspace.txt" "w"] puts $fd [::workspace toString] close $fd } } data.StageHandler {Class ::MD::Stage::Handler Version 1.2 Stages { md-lammps-stage-7da7eb2b-adfa-40fa-9e7b-c8c277c657f1 MD::LAMMPS::Batch ::MD::LAMMPS::Stage { Base { Class ::MD::LAMMPS::Stage Version 1.2 Id md-lammps-stage-7da7eb2b-adfa-40fa-9e7b-c8c277c657f1 Options {-results ::Results -ff ::fF0 -stageid 1 -stdout stdout -master .flowchartDialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} Arrays { myInput {in,text in in,connectedFrom {md-stage-variables-e83a8d2c-ff05-4c72-ac32-64cc0e51df5a out} in,anchor n} myOutput {out,text out out,connectedTo {} out,anchor s} } } Class ::MD::LAMMPS::Stage Version 1.0 StageHandler { Class ::MD::Stage::Handler Version 1.2 Stages { md-lammps-stage-1e8d5a87-2819-48e2-8e7b-1d5c718b7c18 MD::LAMMPS::Batch ::MD::LAMMPS::Stage::NVT { Class ::MD::LAMMPS::Stage::NVT Version 1.2 Id md-lammps-stage-1e8d5a87-2819-48e2-8e7b-1d5c718b7c18 Options {-finaltemperature {$T} -trajectorysampling {0 frames} -timestep {$tstep} -langevin_damping {100.0 fs} -langevin_seed 53 -nose_hoover_drag 0.0 -nose_hoover_damping {100.0 fs} -time {2000 ps} -temperaturecontrol Nose-Hoover -dpd_seed 1234567 -initialtemperature {$T} -sampling {10000 samples} -rescaling_interval 100 -berendsen_damping {100.0 fs} -rescaling_fraction 1.0 -nativetrajectory 0 -rescaling_window 20 -ff ::fF0 -stageid 1 -stdout stdout -master .flowchartDialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} Arrays { myInput {} myOutput {} } } md-lammps-stage-7d9c86de-95d3-43cb-abe8-6abd80b588c8 MD::LAMMPS::Batch ::MD::LAMMPS::Stage::Velocities { Class ::MD::LAMMPS::Stage::Velocities Version 1.2 Id md-lammps-stage-7d9c86de-95d3-43cb-abe8-6abd80b588c8 Options {-zerorotation 0 -autorandom 0 -randomseed 72489 -temperature {$T} -zerotranslation 1 -ff ::fF0 -stageid 1 -stdout stdout -master {} -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} Arrays { myInput {} myOutput {} } } md-stage-start-c1a4116e-d223-4e22-b51c-f7e5bb3b0bb1 {} ::MD::Stage::Start { Class ::MD::Stage::Start Version 1.2 Id md-stage-start-c1a4116e-d223-4e22-b51c-f7e5bb3b0bb1 Options {-description {Replace this with a description of this flowchart!} -summary {A one-line summary of this flowchart!} -stageid 1 -stdout stdout -master {} -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} } md-lammps-stage-e2b14e2e-58a0-492a-b746-bb964fa804b8 MD::LAMMPS::Batch ::MD::LAMMPS::Stage::Initialize { Class ::MD::LAMMPS::Stage::Initialize Version 1.2 Id md-lammps-stage-e2b14e2e-58a0-492a-b746-bb964fa804b8 Options {-architecture GPU -useqeqsm 1 -useqeqreax 1 -nonbondcutoff 9.5 -tailcorrections 1 -kspace_line {} -qeqsmtol 1.0e-6 -qeqreaxtol 1.0e-6 -qeqcombfreq 1 -nonbondmethod PPPM -qeqcombtol 0.01 -nonbondprecision 0.00001 -qeqsmiter 100 -nonbondskin 2.0 -qeqcombwrite 0 -qeqsmfreq 1 -qeqreaxfreq 1 -periodicity {3-d periodic} -useqeqcomb 1 -ff ::fF0 -stageid 1 -stdout stdout -master .flowchartDialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} Arrays { myInput {in,text in in,anchor n in,connectedFrom {md-stage-start-c1a4116e-d223-4e22-b51c-f7e5bb3b0bb1 out}} myOutput {out,text out out,connectedTo {md-lammps-stage-5a30a76d-2f72-4982-8f8c-dbf1386e799c in} out,anchor s} } } } Connections { md-lammps-stage-7d9c86de-95d3-43cb-abe8-6abd80b588c8,md-lammps-stage-1e8d5a87-2819-48e2-8e7b-1d5c718b7c18 1 md-stage-start-c1a4116e-d223-4e22-b51c-f7e5bb3b0bb1,md-lammps-stage-e2b14e2e-58a0-492a-b746-bb964fa804b8 1 md-lammps-stage-e2b14e2e-58a0-492a-b746-bb964fa804b8,md-lammps-stage-7d9c86de-95d3-43cb-abe8-6abd80b588c8 1 } ViewControl-canvas_flowchart { Class ::MDFC::CanvasFlowchart Version 1.2 Background #eff0f1 Steps { md-flowchart-rectangle-721b5e4b-d7b0-40a2-9a86-c6cb5994d183 ::MDFC::CanvasFlowchart::Rectangle { Class ::MDFC::CanvasFlowchart::Rectangle Version 1.2 Id md-flowchart-rectangle-721b5e4b-d7b0-40a2-9a86-c6cb5994d183 Options {-height 120 -selected 0 -description {Temp: $T Time: 2000 ps Step: $tstep Control: Nose-Hoover Sampling: 10000 samples Trajectory: 0 frames} -fill LightBlue -x 104 -width 160 -y 407 -title NVT -stage md-lammps-stage-1e8d5a87-2819-48e2-8e7b-1d5c718b7c18} } md-flowchart-oval-c486d286-3fdb-4e3b-9302-d1ef3f42c633 ::MDFC::CanvasFlowchart::Oval { Class ::MDFC::CanvasFlowchart::Oval Version 1.2 Id md-flowchart-oval-c486d286-3fdb-4e3b-9302-d1ef3f42c633 Options {-height 120 -selected 0 -description {3-d periodic Using ReaxFF potential Run LAMMPS on GPU} -fill LightBlue -x 110 -width 160 -y 94 -title Initialize -stage md-lammps-stage-e2b14e2e-58a0-492a-b746-bb964fa804b8} } md-flowchart-rectangle-38457526-934d-4cc3-bf2c-f3809110ca4f ::MDFC::CanvasFlowchart::Rectangle { Class ::MDFC::CanvasFlowchart::Rectangle Version 1.2 Id md-flowchart-rectangle-38457526-934d-4cc3-bf2c-f3809110ca4f Options {-height 120 -selected 0 -description {Initial velocities for $T No net translation Random seed: 72489} -fill LightBlue -x 110 -width 160 -y 234 -title velocities -stage md-lammps-stage-7d9c86de-95d3-43cb-abe8-6abd80b588c8} } md-flowchart-circle1-3fe28ab8-1d48-4d5b-bbba-349aba214cf8 ::MDFC::CanvasFlowchart::Circle1 { Class ::MDFC::CanvasFlowchart::Circle1 Version 1.2 Id md-flowchart-circle1-3fe28ab8-1d48-4d5b-bbba-349aba214cf8 Options {-height 50 -selected 0 -description {} -fill LightBlue -x 110 -width 50 -y 14 -title Start -stage md-stage-start-c1a4116e-d223-4e22-b51c-f7e5bb3b0bb1} } } Connections { md-flowchart-oval-c486d286-3fdb-4e3b-9302-d1ef3f42c633,md-flowchart-rectangle-38457526-934d-4cc3-bf2c-f3809110ca4f 76 md-flowchart-circle1-3fe28ab8-1d48-4d5b-bbba-349aba214cf8,md-flowchart-oval-c486d286-3fdb-4e3b-9302-d1ef3f42c633 70 md-flowchart-rectangle-38457526-934d-4cc3-bf2c-f3809110ca4f,md-flowchart-rectangle-721b5e4b-d7b0-40a2-9a86-c6cb5994d183 66 } } } } md-stage-variables-e83a8d2c-ff05-4c72-ac32-64cc0e51df5a {} ::MD::Stage::Variables { Class ::MD::Stage::Variables Version 1.2 Id md-stage-variables-e83a8d2c-ff05-4c72-ac32-64cc0e51df5a Options {-data {{tstep 0.2 fs} {T 300 K} {P 0 atm}} -stageid 1 -stdout stdout -master .flowchartDialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} } md-stage-start-b7c84c97-12e9-4f23-859f-ba089890765c {} ::MD::Stage::Start { Class ::MD::Stage::Start Version 1.2 Id md-stage-start-b7c84c97-12e9-4f23-859f-ba089890765c Options {-description {This flowchart performs a LAMMPS molecular dynamics simulation with an NPT ensemble at 300 K and 0 atm for 100 ps to equilibrate the pressure (or density) of the active structure. Start with a large enough supercell of your material with a forcefield assigned. This flowchart assigns the simulations variables with the Variables stage, and the LAMMPS stage has four sub-stages: Initialize, Minimize, Initialize Velocities, and NPT. The variables are: tstep = 1 fs The timestep for the dynamics. We recommended 1-2 fs for organic, inorganic, and metallic forcefields, while that for reactive forcefields such as COMB3 and ReaxFF should be 0.2 fs. T = 300 K The temperature for the dynamics P = 0 atm The pressure for the dynamics } -summary {Simple molecular dynamics simulation} -stageid 1 -stdout stdout -master .dialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} } } Connections { md-stage-variables-e83a8d2c-ff05-4c72-ac32-64cc0e51df5a,md-lammps-stage-7da7eb2b-adfa-40fa-9e7b-c8c277c657f1 1 md-stage-start-b7c84c97-12e9-4f23-859f-ba089890765c,md-stage-variables-e83a8d2c-ff05-4c72-ac32-64cc0e51df5a 1 } ViewControl-canvas_flowchart { Class ::MDFC::CanvasFlowchart Version 1.2 Background #eff0f1 Steps { md-flowchart-circle1-2382c7b8-f3be-4723-a420-1c67d64e4481 ::MDFC::CanvasFlowchart::Circle1 { Class ::MDFC::CanvasFlowchart::Circle1 Version 1.2 Id md-flowchart-circle1-2382c7b8-f3be-4723-a420-1c67d64e4481 Options {-height 50 -selected 0 -description {} -fill #e6eb7a -x 110 -width 50 -y 14 -title Start -stage md-stage-start-b7c84c97-12e9-4f23-859f-ba089890765c} } md-flowchart-oval-75ddd33b-0d5a-4ae2-864a-f08a8810ddef ::MDFC::CanvasFlowchart::Oval { Class ::MDFC::CanvasFlowchart::Oval Version 1.2 Id md-flowchart-oval-75ddd33b-0d5a-4ae2-864a-f08a8810ddef Options {-height 120 -selected 0 -description {tstep = 0.2 fs T = 300 K P = 0 atm} -fill #e6eb7a -x 110 -width 160 -y 94 -title Variables -stage md-stage-variables-e83a8d2c-ff05-4c72-ac32-64cc0e51df5a} } md-flowchart-rectangle-cef7aeae-69f5-457e-9ff1-50bdd013f625 ::MDFC::CanvasFlowchart::Rectangle { Class ::MDFC::CanvasFlowchart::Rectangle Version 1.2 Id md-flowchart-rectangle-cef7aeae-69f5-457e-9ff1-50bdd013f625 Options {-height 120 -selected 0 -description {} -fill #e6eb7a -x 110 -width 160 -y 244 -title LAMMPS -stage md-lammps-stage-7da7eb2b-adfa-40fa-9e7b-c8c277c657f1} } } Connections { md-flowchart-circle1-2382c7b8-f3be-4723-a420-1c67d64e4481,md-flowchart-oval-75ddd33b-0d5a-4ae2-864a-f08a8810ddef 338 md-flowchart-oval-75ddd33b-0d5a-4ae2-864a-f08a8810ddef,md-flowchart-rectangle-cef7aeae-69f5-457e-9ff1-50bdd013f625 344 } } } data.workspace {Class ::MD::Workspace Version 1.0 Packages { MD::Db::MaterialsDesign 1.0 MD::Db::ICSD 1.0 MD::Db::COD 1.0 jobcontrol 3.0 Thread 2.8.7 MD::FF 1.0.1 MD::Db 1.1 MD::Db::Pearson 1.0 database 1.0 MD::Db::MetaDb 1.1 MD::Db::NCD 1.0 MD::Db::Pauling 1.0 Utility 1.0 } Variables { scalar ::__ff ReaxFF_CHONFClSi scalar ::__fffile Forcefields.kit::ReaxFF/CHONFClSi.frc scalar ::MedeADb C:/MD/Databases/MedeA.db array ::Units {scalar energy eV} object ::system {::System {@Title amorphous(Untitled) @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} FFAtomType string {{}} FFCharge double 0.0 Fractional double {{0.0 0.0 0.0}} Name string {{}} Site int 1 Spin double 0.0 WyckoffPosition int -1 @end @data 14 {} Si 0.0 {0.627859 0.258274 0.541679} Si6 1 0.0 -1 8 {} O 0.0 {0.621756 0.252523 0.527394} O6 2 0.0 -1 14 {} Si 0.0 {0.619771 0.242416 0.515632} Si7 3 0.0 -1 8 {} O 0.0 {0.634612 0.240611 0.51123} O7 4 0.0 -1 14 {} Si 0.0 {0.611059 0.259679 0.495679} Si8 5 0.0 -1 7 {} N 0.0 {0.621006 0.258033 0.478934} N2 6 0.0 -1 14 {} Si 0.0 {0.634695 0.250398 0.46983} Si9 7 0.0 -1 14 {} Si 0.0 {0.628685 0.270413 0.486684} Si10 8 0.0 -1 6 {} C 0.0 {0.641546 0.253431 0.549963} C3 9 0.0 -1 7 {} N 0.0 {0.519363 0.641079 0.336681} N 10 0.0 -1 8 {} O 0.0 {0.483882 0.628642 0.336473} O8 11 0.0 -1 8 {} O 0.0 {0.735572 0.392564 0.539519} O9 12 0.0 -1 8 {} O 0.0 {0.588189 0.247627 0.531432} O10 13 0.0 -1 1 {} H 0.0 {0.615318 0.251126 0.505256} H18 14 0.0 -1 1 {} H 0.0 {0.594928 0.261949 0.496234} H19 15 0.0 -1 1 {} H 0.0 {0.625991 0.24694 0.458917} H20 16 0.0 -1 1 {} H 0.0 {0.667935 0.247008 0.448366} H22 17 0.0 -1 1 {} H 0.0 {0.642284 0.264464 0.494359} H24 18 0.0 -1 1 {} H 0.0 {0.618784 0.2729 0.499585} H25 19 0.0 -1 1 {} H 0.0 {0.64411 0.24339 0.550038} H26 20 0.0 -1 1 {} H 0.0 {0.337564 0.802285 0.1064} H27 21 0.0 -1 1 {} H 0.0 {0.64926 0.260821 0.551826} H28 22 0.0 -1 1 {} H 0.0 {0.523686 0.632791 0.340285} H29 23 0.0 -1 1 {} H 0.0 {0.515567 0.645521 0.345195} H31 24 0.0 -1 1 {} H 0.0 {0.489262 0.636248 0.33755} H32 25 0.0 -1 1 {} H 0.0 {0.732106 0.389086 0.550214} H33 26 0.0 -1 1 {} H 0.0 {0.582612 0.240589 0.527284} H34 27 0.0 -1 7 {} N 0.0 {0.637844 0.23445 0.48002} N3 28 0.0 -1 1 {} H 0.0 {0.643019 0.22922 0.473382} H16 29 0.0 -1 1 {} H 0.0 {0.628244 0.231092 0.478789} H17 30 0.0 -1 7 {} N 0.0 {0.633087 0.303134 0.487176} N6 31 0.0 -1 1 {} H 0.0 {0.643173 0.302262 0.484316} H41 32 0.0 -1 1 {} H 0.0 {0.630376 0.312689 0.485757} H42 33 0.0 -1 14 {} Si 0.0 {0.382448 0.589693 0.459645} Si6 34 0.0 -1 8 {} O 0.0 {0.381516 0.602583 0.4684} O6 35 0.0 -1 14 {} Si 0.0 {0.374738 0.61594 0.472349} Si7 36 0.0 -1 8 {} O 0.0 {0.36758 0.610591 0.486481} O7 37 0.0 -1 14 {} Si 0.0 {0.357576 0.600055 0.493959} Si8 38 0.0 -1 7 {} N 0.0 {0.337651 0.603207 0.491793} N2 39 0.0 -1 14 {} Si 0.0 {0.325213 0.609447 0.500602} Si9 40 0.0 -1 14 {} Si 0.0 {0.338794 0.606091 0.475836} Si10 41 0.0 -1 6 {} C 0.0 {0.398699 0.581024 0.456367} C3 42 0.0 -1 7 {} N 0.0 {0.385619 0.631804 0.473956} N 43 0.0 -1 8 {} O 0.0 {0.362848 0.615129 0.462998} O8 44 0.0 -1 8 {} O 0.0 {0.372891 0.594598 0.448096} O9 45 0.0 -1 8 {} O 0.0 {0.370814 0.579213 0.472662} O10 46 0.0 -1 1 {} H 0.0 {0.359309 0.586812 0.487958} H18 47 0.0 -1 1 {} H 0.0 {0.362183 0.599704 0.510583} H19 48 0.0 -1 1 {} H 0.0 {0.332177 0.622632 0.50952} H20 49 0.0 -1 1 {} H 0.0 {0.314853 0.616193 0.492324} H22 50 0.0 -1 1 {} H 0.0 {0.353777 0.611688 0.469054} H24 51 0.0 -1 1 {} H 0.0 {0.331274 0.62249 0.477929} H25 52 0.0 -1 1 {} H 0.0 {0.39847 0.572546 0.450158} H26 53 0.0 -1 1 {} H 0.0 {0.402598 0.577598 0.465447} H27 54 0.0 -1 1 {} H 0.0 {0.405846 0.588267 0.45293} H28 55 0.0 -1 1 {} H 0.0 {0.388638 0.633692 0.464573} H29 56 0.0 -1 1 {} H 0.0 {0.394071 0.628701 0.478433} H31 57 0.0 -1 1 {} H 0.0 {0.342592 0.635579 0.509171} H32 58 0.0 -1 1 {} H 0.0 {0.367942 0.602671 0.450548} H33 59 0.0 -1 1 {} H 0.0 {0.376785 0.578775 0.479967} H34 60 0.0 -1 7 {} N 0.0 {0.319165 0.5956 0.51301} N3 61 0.0 -1 1 {} H 0.0 {0.318535 0.601543 0.521429} H16 62 0.0 -1 1 {} H 0.0 {0.309298 0.593609 0.509745} H17 63 0.0 -1 7 {} N 0.0 {0.330731 0.591933 0.464878} N6 64 0.0 -1 1 {} H 0.0 {0.339684 0.588973 0.461999} H41 65 0.0 -1 1 {} H 0.0 {0.32681 0.585388 0.471325} H42 66 0.0 -1 14 {} Si 0.0 {0.692394 0.4434 0.386577} Si6 67 0.0 -1 8 {} O 0.0 {0.69458 0.437119 0.401862} O6 68 0.0 -1 14 {} Si 0.0 {0.702482 0.427018 0.411218} Si7 69 0.0 -1 8 {} O 0.0 {0.693204 0.386492 0.40404} O7 70 0.0 -1 14 {} Si 0.0 {0.686512 0.400454 0.400177} Si8 71 0.0 -1 7 {} N 0.0 {0.675568 0.380412 0.440909} N2 72 0.0 -1 14 {} Si 0.0 {0.690771 0.376814 0.443967} Si9 73 0.0 -1 14 {} Si 0.0 {0.671971 0.377078 0.425552} Si10 74 0.0 -1 6 {} C 0.0 {0.676204 0.449121 0.380094} C3 75 0.0 -1 7 {} N 0.0 {0.715595 0.416295 0.400769} N 76 0.0 -1 8 {} O 0.0 {0.691111 0.423273 0.429108} O8 77 0.0 -1 8 {} O 0.0 {0.70522 0.431948 0.37657} O9 78 0.0 -1 8 {} O 0.0 {0.704081 0.453538 0.389384} O10 79 0.0 -1 1 {} H 0.0 {0.672752 0.402349 0.404302} H18 80 0.0 -1 1 {} H 0.0 {0.69448 0.413513 0.40608} H19 81 0.0 -1 1 {} H 0.0 {0.701418 0.38092 0.434338} H20 82 0.0 -1 1 {} H 0.0 {0.69923 0.391009 0.444645} H22 83 0.0 -1 1 {} H 0.0 {0.647445 0.369675 0.441058} H24 84 0.0 -1 1 {} H 0.0 {0.670063 0.362339 0.423404} H25 85 0.0 -1 1 {} H 0.0 {0.677057 0.449422 0.369336} H26 86 0.0 -1 1 {} H 0.0 {0.675765 0.459201 0.382575} H27 87 0.0 -1 1 {} H 0.0 {0.667989 0.443767 0.384712} H28 88 0.0 -1 1 {} H 0.0 {0.715829 0.407435 0.405858} H29 89 0.0 -1 1 {} H 0.0 {0.724703 0.420396 0.403768} H31 90 0.0 -1 1 {} H 0.0 {0.691612 0.431339 0.434789} H32 91 0.0 -1 1 {} H 0.0 {0.711212 0.428654 0.383224} H33 92 0.0 -1 1 {} H 0.0 {0.701384 0.460688 0.395372} H34 93 0.0 -1 7 {} N 0.0 {0.693101 0.359919 0.453388} N3 94 0.0 -1 1 {} H 0.0 {0.683225 0.357112 0.454927} H16 95 0.0 -1 1 {} H 0.0 {0.69613 0.354607 0.445501} H17 96 0.0 -1 7 {} N 0.0 {0.655971 0.38673 0.420494} N6 97 0.0 -1 1 {} H 0.0 {0.649628 0.379145 0.422813} H41 98 0.0 -1 1 {} H 0.0 {0.656567 0.392102 0.429103} H42 99 0.0 -1 14 {} Si 0.0 {0.423477 0.555572 0.330356} Si6 100 0.0 -1 8 {} O 0.0 {0.418124 0.54817 0.317575} O6 101 0.0 -1 14 {} Si 0.0 {0.42001 0.539792 0.304484} Si7 102 0.0 -1 8 {} O 0.0 {0.431588 0.547233 0.297507} O7 103 0.0 -1 14 {} Si 0.0 {0.444069 0.556145 0.301932} Si8 104 0.0 -1 7 {} N 0.0 {0.457209 0.554025 0.292041} N2 105 0.0 -1 14 {} Si 0.0 {0.471331 0.545227 0.292704} Si9 106 0.0 -1 14 {} Si 0.0 {0.456209 0.557521 0.275872} Si10 107 0.0 -1 6 {} C 0.0 {0.418096 0.572925 0.335571} C3 108 0.0 -1 7 {} N 0.0 {0.408599 0.533616 0.288079} N 109 0.0 -1 8 {} O 0.0 {0.382245 0.531679 0.229596} O8 110 0.0 -1 8 {} O 0.0 {0.443943 0.553234 0.331264} O9 111 0.0 -1 8 {} O 0.0 {0.421213 0.543934 0.340052} O10 112 0.0 -1 1 {} H 0.0 {0.446216 0.551384 0.319718} H18 113 0.0 -1 1 {} H 0.0 {0.439432 0.572799 0.303367} H19 114 0.0 -1 1 {} H 0.0 {0.47192 0.530042 0.284993} H20 115 0.0 -1 1 {} H 0.0 {0.48407 0.553909 0.289197} H22 116 0.0 -1 1 {} H 0.0 {0.439372 0.563591 0.274842} H24 117 0.0 -1 1 {} H 0.0 {0.457332 0.544767 0.263571} H25 118 0.0 -1 1 {} H 0.0 {0.411778 0.57079 0.343239} H26 119 0.0 -1 1 {} H 0.0 {0.413839 0.578096 0.327475} H27 120 0.0 -1 1 {} H 0.0 {0.426565 0.578832 0.339037} H28 121 0.0 -1 1 {} H 0.0 {0.410315 0.540361 0.280408} H29 122 0.0 -1 1 {} H 0.0 {0.399463 0.536973 0.291247} H31 123 0.0 -1 1 {} H 0.0 {0.385087 0.527532 0.237634} H32 124 0.0 -1 1 {} H 0.0 {0.444797 0.543817 0.334674} H33 125 0.0 -1 1 {} H 0.0 {0.42611 0.52764 0.307641} H34 126 0.0 -1 7 {} N 0.0 {0.474122 0.541641 0.311437} N3 127 0.0 -1 1 {} H 0.0 {0.479308 0.550086 0.314007} H16 128 0.0 -1 1 {} H 0.0 {0.464929 0.542109 0.315096} H17 129 0.0 -1 7 {} N 0.0 {0.468033 0.572926 0.271674} N6 130 0.0 -1 1 {} H 0.0 {0.469567 0.582282 0.274263} H41 131 0.0 -1 1 {} H 0.0 {0.463427 0.574078 0.262621} H42 132 0.0 -1 14 {} Si 0.0 {0.436215 0.333645 0.51687} Si6 133 0.0 -1 8 {} O 0.0 {0.42738 0.331387 0.503991} O6 134 0.0 -1 14 {} Si 0.0 {0.418875 0.334533 0.490984} Si7 135 0.0 -1 8 {} O 0.0 {0.431055 0.34154 0.483246} O7 136 0.0 -1 14 {} Si 0.0 {0.443579 0.338897 0.473517} Si8 137 0.0 -1 7 {} N 0.0 {0.459675 0.342986 0.476239} N2 138 0.0 -1 14 {} Si 0.0 {0.475121 0.342232 0.471106} Si9 139 0.0 -1 14 {} Si 0.0 {0.459837 0.35128 0.490433} Si10 140 0.0 -1 6 {} C 0.0 {0.432831 0.346178 0.527801} C3 141 0.0 -1 7 {} N 0.0 {0.409801 0.320176 0.481956} N 142 0.0 -1 8 {} O 0.0 {0.40723 0.345501 0.495103} O8 143 0.0 -1 8 {} O 0.0 {0.454967 0.329521 0.510391} O9 144 0.0 -1 8 {} O 0.0 {0.434389 0.313293 0.52133} O10 145 0.0 -1 1 {} H 0.0 {0.438991 0.322814 0.467655} H18 146 0.0 -1 1 {} H 0.0 {0.443168 0.348102 0.459408} H19 147 0.0 -1 1 {} H 0.0 {0.47162 0.338394 0.456456} H20 148 0.0 -1 1 {} H 0.0 {0.484858 0.354125 0.47081} H22 149 0.0 -1 1 {} H 0.0 {0.476378 0.358223 0.494461} H24 150 0.0 -1 1 {} H 0.0 {0.457028 0.338512 0.502456} H25 151 0.0 -1 1 {} H 0.0 {0.438777 0.343762 0.541472} H26 152 0.0 -1 1 {} H 0.0 {0.422354 0.346172 0.528514} H27 153 0.0 -1 1 {} H 0.0 {0.435746 0.35517 0.52201} H28 154 0.0 -1 1 {} H 0.0 {0.40666 0.325417 0.473233} H29 155 0.0 -1 1 {} H 0.0 {0.401368 0.317143 0.48682} H31 156 0.0 -1 1 {} H 0.0 {0.41166 0.353644 0.500089} H32 157 0.0 -1 1 {} H 0.0 {0.452834 0.322711 0.503853} H33 158 0.0 -1 1 {} H 0.0 {0.427924 0.309956 0.514528} H34 159 0.0 -1 7 {} N 0.0 {0.483156 0.325037 0.477417} N3 160 0.0 -1 1 {} H 0.0 {0.484249 0.320141 0.468423} H16 161 0.0 -1 1 {} H 0.0 {0.49224 0.326413 0.481631} H17 162 0.0 -1 7 {} N 0.0 {0.448506 0.367714 0.492013} N6 163 0.0 -1 1 {} H 0.0 {0.439733 0.36415 0.488831} H41 164 0.0 -1 1 {} H 0.0 {0.44731 0.367395 0.502166} H42 165 0.0 -1 14 {} Si 0.0 {0.46038 0.528226 0.418507} Si6 166 0.0 -1 8 {} O 0.0 {0.463013 0.524886 0.433822} O6 167 0.0 -1 14 {} Si 0.0 {0.461918 0.534414 0.446911} Si7 168 0.0 -1 8 {} O 0.0 {0.446773 0.533701 0.450958} O7 169 0.0 -1 14 {} Si 0.0 {0.432179 0.53518 0.445355} Si8 170 0.0 -1 7 {} N 0.0 {0.419982 0.520116 0.440084} N2 171 0.0 -1 14 {} Si 0.0 {0.432208 0.509633 0.43622} Si9 172 0.0 -1 14 {} Si 0.0 {0.404803 0.516643 0.447121} Si10 173 0.0 -1 6 {} C 0.0 {0.442912 0.531268 0.412111} C3 174 0.0 -1 7 {} N 0.0 {0.474709 0.529626 0.464062} N 175 0.0 -1 8 {} O 0.0 {0.461223 0.548518 0.440214} O8 176 0.0 -1 8 {} O 0.0 {0.472732 0.511435 0.413807} O9 177 0.0 -1 8 {} O 0.0 {0.47282 0.538576 0.415808} O10 178 0.0 -1 1 {} H 0.0 {0.421812 0.542927 0.455759} H18 179 0.0 -1 1 {} H 0.0 {0.432806 0.544045 0.433753} H19 180 0.0 -1 1 {} H 0.0 {0.428 0.504963 0.41998} H20 181 0.0 -1 1 {} H 0.0 {0.444913 0.517133 0.435756} H22 182 0.0 -1 1 {} H 0.0 {0.397429 0.508072 0.435532} H24 183 0.0 -1 1 {} H 0.0 {0.40059 0.528766 0.449487} H25 184 0.0 -1 1 {} H 0.0 {0.440593 0.522649 0.405825} H26 185 0.0 -1 1 {} H 0.0 {0.442569 0.539644 0.405789} H27 186 0.0 -1 1 {} H 0.0 {0.438364 0.530603 0.421668} H28 187 0.0 -1 1 {} H 0.0 {0.479052 0.537761 0.467789} H29 188 0.0 -1 1 {} H 0.0 {0.48257 0.523502 0.459885} H31 189 0.0 -1 1 {} H 0.0 {0.465941 0.548735 0.431536} H32 190 0.0 -1 1 {} H 0.0 {0.476357 0.510235 0.422464} H33 191 0.0 -1 1 {} H 0.0 {0.481029 0.535012 0.420951} H34 192 0.0 -1 7 {} N 0.0 {0.432862 0.492776 0.447296} N3 193 0.0 -1 1 {} H 0.0 {0.442756 0.493715 0.447982} H16 194 0.0 -1 1 {} H 0.0 {0.431453 0.48618 0.439415} H17 195 0.0 -1 7 {} N 0.0 {0.405747 0.505501 0.462837} N6 196 0.0 -1 1 {} H 0.0 {0.413708 0.499891 0.461535} H41 197 0.0 -1 1 {} H 0.0 {0.408355 0.514054 0.46806} H42 198 0.0 -1 14 {} Si 0.0 {0.612568 0.325347 0.442304} Si6 199 0.0 -1 8 {} O 0.0 {0.610259 0.324566 0.426409} O6 200 0.0 -1 14 {} Si 0.0 {0.47835 0.406403 0.77651} Si7 201 0.0 -1 8 {} O 0.0 {0.47187 0.41961 0.770109} O7 202 0.0 -1 14 {} Si 0.0 {0.466907 0.426294 0.756949} Si8 203 0.0 -1 7 {} N 0.0 {0.469829 0.373384 0.755409} N2 204 0.0 -1 14 {} Si 0.0 {0.456606 0.365814 0.750839} Si9 205 0.0 -1 14 {} Si 0.0 {0.476995 0.387668 0.755332} Si10 206 0.0 -1 6 {} C 0.0 {0.602646 0.316617 0.455492} C3 207 0.0 -1 7 {} N 0.0 {0.472771 0.400257 0.793746} N 208 0.0 -1 8 {} O 0.0 {0.641982 0.337066 0.402577} O8 209 0.0 -1 8 {} O 0.0 {0.61428 0.341766 0.44466} O9 210 0.0 -1 8 {} O 0.0 {0.631445 0.323911 0.441886} O10 211 0.0 -1 1 {} H 0.0 {0.445823 0.432817 0.747334} H18 212 0.0 -1 1 {} H 0.0 {0.471801 0.418904 0.746465} H19 213 0.0 -1 1 {} H 0.0 {0.445769 0.366808 0.763994} H20 214 0.0 -1 1 {} H 0.0 {0.430762 0.70095 0.578269} H22 215 0.0 -1 1 {} H 0.0 {0.477833 0.396865 0.766257} H24 216 0.0 -1 1 {} H 0.0 {0.494929 0.381426 0.755071} H25 217 0.0 -1 1 {} H 0.0 {0.602801 0.322806 0.464602} H26 218 0.0 -1 1 {} H 0.0 {0.607605 0.30716 0.457292} H27 219 0.0 -1 1 {} H 0.0 {0.592677 0.315704 0.451431} H28 220 0.0 -1 1 {} H 0.0 {0.471919 0.409976 0.797614} H29 221 0.0 -1 1 {} H 0.0 {0.463062 0.398491 0.791409} H31 222 0.0 -1 1 {} H 0.0 {0.618151 0.322514 0.421415} H32 223 0.0 -1 1 {} H 0.0 {0.632628 0.337652 0.399505} H33 224 0.0 -1 1 {} H 0.0 {0.633492 0.320523 0.433217} H34 225 0.0 -1 7 {} N 0.0 {0.447943 0.52307 0.766732} N3 226 0.0 -1 1 {} H 0.0 {0.438814 0.523587 0.770913} H16 227 0.0 -1 1 {} H 0.0 {0.450139 0.53228 0.761119} H17 228 0.0 -1 7 {} N 0.0 {0.459482 0.518728 0.776268} N6 229 0.0 -1 1 {} H 0.0 {0.458572 0.509087 0.780598} H41 230 0.0 -1 1 {} H 0.0 {0.469503 0.519941 0.774031} H42 231 0.0 -1 14 {} Si 0.0 {0.291885 0.411202 0.601464} Si6 232 0.0 -1 8 {} O 0.0 {0.280166 0.405459 0.610177} O6 233 0.0 -1 14 {} Si 0.0 {0.270588 0.405574 0.622538} Si7 234 0.0 -1 8 {} O 0.0 {0.26038 0.417166 0.618211} O7 235 0.0 -1 14 {} Si 0.0 {0.262017 0.430326 0.609359} Si8 236 0.0 -1 7 {} N 0.0 {0.25904 0.444242 0.617762} N2 237 0.0 -1 14 {} Si 0.0 {0.264573 0.442527 0.632856} Si9 238 0.0 -1 14 {} Si 0.0 {0.253959 0.45977 0.615988} Si10 239 0.0 -1 6 {} C 0.0 {0.30963 0.404098 0.600115} C3 240 0.0 -1 7 {} N 0.0 {0.257991 0.390847 0.63128} N 241 0.0 -1 8 {} O 0.0 {0.281419 0.415735 0.632252} O8 242 0.0 -1 8 {} O 0.0 {0.290884 0.426972 0.603487} O9 243 0.0 -1 8 {} O 0.0 {0.280998 0.412533 0.585471} O10 244 0.0 -1 1 {} H 0.0 {0.279378 0.428764 0.605248} H18 245 0.0 -1 1 {} H 0.0 {0.250772 0.430167 0.594809} H19 246 0.0 -1 1 {} H 0.0 {0.214152 0.456289 0.602896} H20 247 0.0 -1 1 {} H 0.0 {0.272937 0.429138 0.631957} H22 248 0.0 -1 1 {} H 0.0 {0.238872 0.459909 0.612307} H24 249 0.0 -1 1 {} H 0.0 {0.21321 0.432414 0.532532} H25 250 0.0 -1 1 {} H 0.0 {0.308795 0.394339 0.603538} H26 251 0.0 -1 1 {} H 0.0 {0.317066 0.409782 0.604874} H27 252 0.0 -1 1 {} H 0.0 {0.311834 0.403433 0.5897} H28 253 0.0 -1 1 {} H 0.0 {0.247633 0.39044 0.630371} H29 254 0.0 -1 1 {} H 0.0 {0.259876 0.389754 0.641071} H31 255 0.0 -1 1 {} H 0.0 {0.288847 0.416614 0.626077} H32 256 0.0 -1 1 {} H 0.0 {0.283747 0.499069 0.560826} H33 257 0.0 -1 1 {} H 0.0 {0.287006 0.409287 0.577639} H34 258 0.0 -1 7 {} N 0.0 {0.556454 0.528323 0.742014} N3 259 0.0 -1 1 {} H 0.0 {0.554051 0.52106 0.735074} H16 260 0.0 -1 1 {} H 0.0 {0.552969 0.537532 0.73823} H17 261 0.0 -1 7 {} N 0.0 {0.262053 0.465943 0.599279} N6 262 0.0 -1 1 {} H 0.0 {0.270975 0.461865 0.599154} H41 263 0.0 -1 1 {} H 0.0 {0.256167 0.461585 0.592473} H42 264 0.0 -1 14 {} Si 0.0 {0.516027 0.228485 0.327539} Si6 265 0.0 -1 8 {} O 0.0 {0.555489 0.236674 0.330555} O6 266 0.0 -1 14 {} Si 0.0 {0.542702 0.244371 0.324248} Si7 267 0.0 -1 8 {} O 0.0 {0.547674 0.252159 0.310649} O7 268 0.0 -1 14 {} Si 0.0 {0.557751 0.230075 0.37234} Si8 269 0.0 -1 7 {} N 0.0 {0.563114 0.242472 0.36322} N2 270 0.0 -1 14 {} Si 0.0 {0.578514 0.239457 0.361211} Si9 271 0.0 -1 14 {} Si 0.0 {0.558013 0.257189 0.35861} Si10 272 0.0 -1 6 {} C 0.0 {0.511199 0.211919 0.327864} C3 273 0.0 -1 7 {} N 0.0 {0.354943 0.320091 0.390586} N 274 0.0 -1 8 {} O 0.0 {0.536132 0.253941 0.336541} O8 275 0.0 -1 8 {} O 0.0 {0.531516 0.233615 0.323574} O9 276 0.0 -1 8 {} O 0.0 {0.506275 0.240697 0.324851} O10 277 0.0 -1 1 {} H 0.0 {0.540207 0.644771 0.651392} H18 278 0.0 -1 1 {} H 0.0 {0.544369 0.233665 0.379114} H19 279 0.0 -1 1 {} H 0.0 {0.538199 0.226803 0.422126} H20 280 0.0 -1 1 {} H 0.0 {0.362453 0.325335 0.38465} H22 281 0.0 -1 1 {} H 0.0 {0.546517 0.25606 0.345318} H24 282 0.0 -1 1 {} H 0.0 {0.570891 0.266777 0.352022} H25 283 0.0 -1 1 {} H 0.0 {0.802764 0.43268 0.519103} H26 284 0.0 -1 1 {} H 0.0 {0.520323 0.207298 0.331021} H27 285 0.0 -1 1 {} H 0.0 {0.50768 0.208057 0.318888} H28 286 0.0 -1 1 {} H 0.0 {0.347484 0.326562 0.393017} H29 287 0.0 -1 1 {} H 0.0 {0.35902 0.317122 0.399769} H31 288 0.0 -1 1 {} H 0.0 {0.373316 0.259187 0.621533} H32 289 0.0 -1 1 {} H 0.0 {0.383414 0.267988 0.501632} H33 290 0.0 -1 1 {} H 0.0 {0.529338 0.246496 0.343488} H34 291 0.0 -1 7 {} N 0.0 {0.583043 0.235794 0.343342} N3 292 0.0 -1 1 {} H 0.0 {0.710998 0.945962 0.525369} H16 293 0.0 -1 1 {} H 0.0 {0.712144 0.95248 0.522052} H17 294 0.0 -1 7 {} N 0.0 {0.550385 0.265722 0.373039} N6 295 0.0 -1 1 {} H 0.0 {0.544752 0.258897 0.377414} H41 296 0.0 -1 1 {} H 0.0 {0.559096 0.266045 0.378956} H42 297 0.0 -1 14 {} Si 0.0 {0.518483 0.228307 0.476075} Si6 298 0.0 -1 8 {} O 0.0 {0.52202 0.242512 0.472772} O6 299 0.0 -1 14 {} Si 0.0 {0.527769 0.256917 0.473534} Si7 300 0.0 -1 8 {} O 0.0 {0.520054 0.261245 0.488655} O7 301 0.0 -1 14 {} Si 0.0 {0.521058 0.267526 0.50269} Si8 302 0.0 -1 7 {} N 0.0 {0.523783 0.25614 0.518536} N2 303 0.0 -1 14 {} Si 0.0 {0.527362 0.260683 0.533568} Si9 304 0.0 -1 14 {} Si 0.0 {0.516735 0.242961 0.512298} Si10 305 0.0 -1 6 {} C 0.0 {0.500389 0.223597 0.477776} C3 306 0.0 -1 7 {} N 0.0 {0.526054 0.271396 0.461079} N 307 0.0 -1 8 {} O 0.0 {0.500491 0.288258 0.504882} O8 308 0.0 -1 8 {} O 0.0 {0.530497 0.225174 0.49267} O9 309 0.0 -1 8 {} O 0.0 {0.527534 0.221898 0.464133} O10 310 0.0 -1 1 {} H 0.0 {0.533205 0.27412 0.505619} H18 311 0.0 -1 1 {} H 0.0 {0.508666 0.279677 0.503934} H19 312 0.0 -1 1 {} H 0.0 {0.515692 0.268995 0.539885} H20 313 0.0 -1 1 {} H 0.0 {0.530069 0.250518 0.542274} H22 314 0.0 -1 1 {} H 0.0 {0.526336 0.232856 0.502178} H24 315 0.0 -1 1 {} H 0.0 {0.503419 0.248829 0.500943} H25 316 0.0 -1 1 {} H 0.0 {0.496526 0.217631 0.469882} H26 317 0.0 -1 1 {} H 0.0 {0.494562 0.232589 0.478215} H27 318 0.0 -1 1 {} H 0.0 {0.499907 0.21743 0.485942} H28 319 0.0 -1 1 {} H 0.0 {0.589786 0.247177 0.371991} H29 320 0.0 -1 1 {} H 0.0 {0.518284 0.2772 0.463931} H31 321 0.0 -1 1 {} H 0.0 {0.497217 0.289443 0.495292} H32 322 0.0 -1 1 {} H 0.0 {0.53896 0.229008 0.489636} H33 323 0.0 -1 1 {} H 0.0 {0.531101 0.243194 0.453111} H34 324 0.0 -1 7 {} N 0.0 {0.580559 0.342165 0.638558} N3 325 0.0 -1 1 {} H 0.0 {0.572842 0.338166 0.633329} H16 326 0.0 -1 1 {} H 0.0 {0.583129 0.350746 0.633917} H17 327 0.0 -1 7 {} N 0.0 {0.502015 0.237587 0.522976} N6 328 0.0 -1 1 {} H 0.0 {0.493679 0.243212 0.520722} H41 329 0.0 -1 1 {} H 0.0 {0.500155 0.228881 0.518508} H42 330 0.0 -1 14 {} Si 0.0 {0.395855 0.32584 0.718207} Si6 331 0.0 -1 8 {} O 0.0 {0.410645 0.325246 0.713019} O6 332 0.0 -1 14 {} Si 0.0 {0.423958 0.31877 0.708493} Si7 333 0.0 -1 8 {} O 0.0 {0.419995 0.303583 0.710493} O7 334 0.0 -1 14 {} Si 0.0 {0.415862 0.289705 0.716124} Si8 335 0.0 -1 7 {} N 0.0 {0.41198 0.28863 0.731753} N2 336 0.0 -1 14 {} Si 0.0 {0.315914 0.577256 0.590886} Si9 337 0.0 -1 14 {} Si 0.0 {0.421748 0.292938 0.743427} Si10 338 0.0 -1 6 {} C 0.0 {0.380664 0.319913 0.709427} C3 339 0.0 -1 7 {} N 0.0 {0.431132 0.266131 0.717679} N 340 0.0 -1 8 {} O 0.0 {0.451553 0.354262 0.717334} O8 341 0.0 -1 8 {} O 0.0 {0.395298 0.341795 0.722353} O9 342 0.0 -1 8 {} O 0.0 {0.399342 0.318038 0.736794} O10 343 0.0 -1 1 {} H 0.0 {0.450514 0.274006 0.69612} H18 344 0.0 -1 1 {} H 0.0 {0.49324 0.426146 0.725287} H19 345 0.0 -1 1 {} H 0.0 {0.31765 0.594603 0.591915} H20 346 0.0 -1 1 {} H 0.0 {0.491383 0.428572 0.732966} H22 347 0.0 -1 1 {} H 0.0 {0.416017 0.304059 0.750431} H24 348 0.0 -1 1 {} H 0.0 {0.404321 0.309493 0.734816} H25 349 0.0 -1 1 {} H 0.0 {0.374384 0.311606 0.71384} H26 350 0.0 -1 1 {} H 0.0 {0.382537 0.316452 0.699426} H27 351 0.0 -1 1 {} H 0.0 {0.374708 0.329336 0.709479} H28 352 0.0 -1 1 {} H 0.0 {0.43934 0.263049 0.723212} H29 353 0.0 -1 1 {} H 0.0 {0.425887 0.270448 0.725496} H31 354 0.0 -1 1 {} H 0.0 {0.442986 0.354054 0.714021} H32 355 0.0 -1 1 {} H 0.0 {0.402811 0.34659 0.717574} H33 356 0.0 -1 1 {} H 0.0 {0.424746 0.343551 0.761815} H34 357 0.0 -1 7 {} N 0.0 {0.325314 0.57202 0.574949} N3 358 0.0 -1 1 {} H 0.0 {0.324588 0.562067 0.577083} H16 359 0.0 -1 1 {} H 0.0 {0.318073 0.573978 0.568642} H17 360 0.0 -1 7 {} N 0.0 {0.421721 0.275935 0.753634} N6 361 0.0 -1 1 {} H 0.0 {0.429475 0.270877 0.749863} H41 362 0.0 -1 1 {} H 0.0 {0.413976 0.271952 0.748529} H42 363 0.0 -1 14 {} Si 0.0 {0.504352 0.328641 0.588922} Si6 364 0.0 -1 8 {} O 0.0 {0.491394 0.331284 0.59709} O6 365 0.0 -1 14 {} Si 0.0 {0.481111 0.328317 0.608964} Si7 366 0.0 -1 8 {} O 0.0 {0.491604 0.323317 0.619299} O7 367 0.0 -1 14 {} Si 0.0 {0.500812 0.323952 0.63228} Si8 368 0.0 -1 7 {} N 0.0 {0.500477 0.312241 0.644239} N2 369 0.0 -1 14 {} Si 0.0 {0.502044 0.296725 0.638723} Si9 370 0.0 -1 14 {} Si 0.0 {0.498802 0.308749 0.66027} Si10 371 0.0 -1 6 {} C 0.0 {0.511175 0.311193 0.589902} C3 372 0.0 -1 7 {} N 0.0 {0.470813 0.344905 0.610322} N 373 0.0 -1 8 {} O 0.0 {0.475772 0.313761 0.605457} O8 374 0.0 -1 8 {} O 0.0 {0.513403 0.34074 0.594347} O9 375 0.0 -1 8 {} O 0.0 {0.496302 0.337354 0.572641} O10 376 0.0 -1 1 {} H 0.0 {0.468927 0.39001 0.685714} H18 377 0.0 -1 1 {} H 0.0 {0.516746 0.324832 0.62446} H19 378 0.0 -1 1 {} H 0.0 {0.518529 0.293072 0.639029} H20 379 0.0 -1 1 {} H 0.0 {0.498361 0.299504 0.620013} H22 380 0.0 -1 1 {} H 0.0 {0.488192 0.302166 0.666719} H24 381 0.0 -1 1 {} H 0.0 {0.510164 0.315655 0.670652} H25 382 0.0 -1 1 {} H 0.0 {0.508078 0.307531 0.579806} H26 383 0.0 -1 1 {} H 0.0 {0.505329 0.306055 0.596751} H27 384 0.0 -1 1 {} H 0.0 {0.522016 0.311214 0.591456} H28 385 0.0 -1 1 {} H 0.0 {0.461412 0.342446 0.607446} H29 386 0.0 -1 1 {} H 0.0 {0.474866 0.350335 0.601917} H31 387 0.0 -1 1 {} H 0.0 {0.468597 0.310946 0.613142} H32 388 0.0 -1 1 {} H 0.0 {0.508154 0.348647 0.596165} H33 389 0.0 -1 1 {} H 0.0 {0.489466 0.342758 0.577003} H34 390 0.0 -1 7 {} N 0.0 {0.506285 0.340745 0.64126} N3 391 0.0 -1 1 {} H 0.0 {0.497216 0.34325 0.645206} H16 392 0.0 -1 1 {} H 0.0 {0.511393 0.33787 0.649557} H17 393 0.0 -1 7 {} N 0.0 {0.474859 0.302592 0.690757} N6 394 0.0 -1 1 {} H 0.0 {0.475056 0.294163 0.696528} H41 395 0.0 -1 1 {} H 0.0 {0.48266 0.308983 0.68978} H42 396 0.0 -1 14 {} Si 0.0 {0.365229 0.66941 0.525609} Si6 397 0.0 -1 8 {} O 0.0 {0.573099 0.257021 0.579901} O6 398 0.0 -1 14 {} Si 0.0 {0.541835 0.283412 0.56515} Si7 399 0.0 -1 8 {} O 0.0 {0.555868 0.287689 0.570731} O7 400 0.0 -1 14 {} Si 0.0 {0.567978 0.297073 0.568231} Si8 401 0.0 -1 7 {} N 0.0 {0.532721 0.254025 0.59217} N2 402 0.0 -1 14 {} Si 0.0 {0.396411 0.669534 0.527004} Si9 403 0.0 -1 14 {} Si 0.0 {0.543285 0.262954 0.584077} Si10 404 0.0 -1 6 {} C 0.0 {0.356789 0.655844 0.535496} C3 405 0.0 -1 7 {} N 0.0 {0.535941 0.264524 0.563928} N 406 0.0 -1 8 {} O 0.0 {0.531406 0.293999 0.572526} O8 407 0.0 -1 8 {} O 0.0 {0.362564 0.68502 0.52452} O9 408 0.0 -1 8 {} O 0.0 {0.400498 0.667955 0.511915} O10 409 0.0 -1 1 {} H 0.0 {0.580737 0.289197 0.567803} H18 410 0.0 -1 1 {} H 0.0 {0.565438 0.308901 0.5562} H19 411 0.0 -1 1 {} H 0.0 {0.397864 0.684795 0.529108} H20 412 0.0 -1 1 {} H 0.0 {0.381664 0.669374 0.52726} H22 413 0.0 -1 1 {} H 0.0 {0.577437 0.266397 0.58139} H24 414 0.0 -1 1 {} H 0.0 {0.359839 0.656354 0.545745} H25 415 0.0 -1 1 {} H 0.0 {0.346086 0.656002 0.534759} H26 416 0.0 -1 1 {} H 0.0 {0.588507 0.275564 0.550319} H27 417 0.0 -1 1 {} H 0.0 {0.360022 0.646004 0.531998} H28 418 0.0 -1 1 {} H 0.0 {0.544261 0.26111 0.558984} H29 419 0.0 -1 1 {} H 0.0 {0.529583 0.2566 0.562534} H31 420 0.0 -1 1 {} H 0.0 {0.524953 0.288278 0.577698} H32 421 0.0 -1 1 {} H 0.0 {0.352997 0.686241 0.525487} H33 422 0.0 -1 1 {} H 0.0 {0.569034 0.308116 0.580742} H34 423 0.0 -1 7 {} N 0.0 {0.39651 0.662413 0.545659} N3 424 0.0 -1 1 {} H 0.0 {0.394437 0.653174 0.543425} H16 425 0.0 -1 1 {} H 0.0 {0.387955 0.66726 0.54913} H17 426 0.0 -1 7 {} N 0.0 {0.605205 0.705259 0.514899} N6 427 0.0 -1 1 {} H 0.0 {0.561802 0.25855 0.582015} H41 428 0.0 -1 1 {} H 0.0 {0.609706 0.69995 0.522433} H42 429 0.0 -1 14 {} Si 0.0 {0.669206 0.496559 0.360231} Si6 430 0.0 -1 8 {} O 0.0 {0.658251 0.489573 0.351604} O6 431 0.0 -1 14 {} Si 0.0 {0.644501 0.48807 0.344108} Si7 432 0.0 -1 8 {} O 0.0 {0.63393 0.490512 0.35516} O7 433 0.0 -1 14 {} Si 0.0 {0.626224 0.485373 0.367554} Si8 434 0.0 -1 7 {} N 0.0 {0.619009 0.498915 0.379766} N2 435 0.0 -1 14 {} Si 0.0 {0.63394 0.512904 0.379867} Si9 436 0.0 -1 14 {} Si 0.0 {0.601541 0.50628 0.383161} Si10 437 0.0 -1 6 {} C 0.0 {0.503622 0.536286 0.726387} C3 438 0.0 -1 7 {} N 0.0 {0.64079 0.473824 0.330898} N 439 0.0 -1 8 {} O 0.0 {0.670619 0.448422 0.417497} O8 440 0.0 -1 8 {} O 0.0 {0.457019 0.517303 0.740637} O9 441 0.0 -1 8 {} O 0.0 {0.428866 0.600619 0.673152} O10 442 0.0 -1 1 {} H 0.0 {0.613201 0.477083 0.362551} H18 443 0.0 -1 1 {} H 0.0 {0.638544 0.477266 0.375308} H19 444 0.0 -1 1 {} H 0.0 {0.63087 0.521503 0.389787} H20 445 0.0 -1 1 {} H 0.0 {0.642974 0.501498 0.386432} H22 446 0.0 -1 1 {} H 0.0 {0.590723 0.498052 0.376103} H24 447 0.0 -1 1 {} H 0.0 {0.598897 0.518903 0.380389} H25 448 0.0 -1 1 {} H 0.0 {0.511505 0.539118 0.720469} H26 449 0.0 -1 1 {} H 0.0 {0.502089 0.541225 0.735554} H27 450 0.0 -1 1 {} H 0.0 {0.678959 0.442826 0.415603} H28 451 0.0 -1 1 {} H 0.0 {0.64778 0.46686 0.334124} H29 452 0.0 -1 1 {} H 0.0 {0.63216 0.470016 0.334969} H31 453 0.0 -1 1 {} H 0.0 {0.668319 0.446034 0.427037} H32 454 0.0 -1 1 {} H 0.0 {0.451725 0.515189 0.748429} H33 455 0.0 -1 1 {} H 0.0 {0.42623 0.597107 0.663824} H34 456 0.0 -1 7 {} N 0.0 {0.63632 0.522019 0.361489} N3 457 0.0 -1 1 {} H 0.0 {0.626628 0.524843 0.360257} H16 458 0.0 -1 1 {} H 0.0 {0.637456 0.51282 0.357758} H17 459 0.0 -1 7 {} N 0.0 {0.599742 0.503366 0.401321} N6 460 0.0 -1 1 {} H 0.0 {0.598976 0.513266 0.404212} H41 461 0.0 -1 1 {} H 0.0 {0.590083 0.49942 0.402992} H42 462 0.0 -1 14 {} Si 0.0 {0.290891 0.629614 0.511006} Si6 463 0.0 -1 8 {} O 0.0 {0.24369 0.659406 0.516706} O6 464 0.0 -1 14 {} Si 0.0 {0.25408 0.647654 0.520921} Si7 465 0.0 -1 8 {} O 0.0 {0.251599 0.635135 0.51084} O7 466 0.0 -1 14 {} Si 0.0 {0.240407 0.62535 0.505144} Si8 467 0.0 -1 7 {} N 0.0 {0.397893 0.251507 0.625171} N2 468 0.0 -1 14 {} Si 0.0 {0.380975 0.24252 0.619491} Si9 469 0.0 -1 14 {} Si 0.0 {0.391091 0.242328 0.641706} Si10 470 0.0 -1 6 {} C 0.0 {0.282032 0.619559 0.521386} C3 471 0.0 -1 7 {} N 0.0 {0.679489 0.590818 0.301336} N 472 0.0 -1 8 {} O 0.0 {0.263541 0.640149 0.537923} O8 473 0.0 -1 8 {} O 0.0 {0.409952 0.221868 0.620706} O9 474 0.0 -1 8 {} O 0.0 {0.274133 0.608981 0.510235} O10 475 0.0 -1 1 {} H 0.0 {0.200615 0.605729 0.457774} H18 476 0.0 -1 1 {} H 0.0 {0.237397 0.612407 0.515537} H19 477 0.0 -1 1 {} H 0.0 {0.383074 0.207099 0.558602} H20 478 0.0 -1 1 {} H 0.0 {0.365367 0.245106 0.614476} H22 479 0.0 -1 1 {} H 0.0 {0.38108 0.233924 0.633059} H24 480 0.0 -1 1 {} H 0.0 {0.383222 0.250776 0.652424} H25 481 0.0 -1 1 {} H 0.0 {0.288177 0.613052 0.526904} H26 482 0.0 -1 1 {} H 0.0 {0.27646 0.625143 0.527616} H27 483 0.0 -1 1 {} H 0.0 {0.402751 0.224571 0.61448} H28 484 0.0 -1 1 {} H 0.0 {0.227711 0.634697 0.499424} H29 485 0.0 -1 1 {} H 0.0 {0.682959 0.583121 0.295436} H31 486 0.0 -1 1 {} H 0.0 {0.250281 0.619567 0.489949} H32 487 0.0 -1 1 {} H 0.0 {0.406138 0.227009 0.628856} H33 488 0.0 -1 1 {} H 0.0 {0.271688 0.615995 0.503085} H34 489 0.0 -1 7 {} N 0.0 {0.38777 0.234223 0.602444} N3 490 0.0 -1 1 {} H 0.0 {0.378476 0.233499 0.597712} H16 491 0.0 -1 1 {} H 0.0 {0.393131 0.242352 0.600554} H17 492 0.0 -1 7 {} N 0.0 {0.402557 0.232549 0.648253} N6 493 0.0 -1 1 {} H 0.0 {0.400005 0.228243 0.657097} H41 494 0.0 -1 1 {} H 0.0 {0.410635 0.23829 0.649354} H42 495 0.0 -1 14 {} Si 0.0 {0.587149 0.399589 0.35794} Si6 496 0.0 -1 8 {} O 0.0 {0.580379 0.39231 0.34572} O6 497 0.0 -1 14 {} Si 0.0 {0.580015 0.423359 0.344213} Si7 498 0.0 -1 8 {} O 0.0 {0.569214 0.422866 0.35617} O7 499 0.0 -1 14 {} Si 0.0 {0.578357 0.394658 0.440164} Si8 500 0.0 -1 7 {} N 0.0 {0.592351 0.382873 0.442491} N2 501 0.0 -1 14 {} Si 0.0 {0.572723 0.396597 0.332565} Si9 502 0.0 -1 14 {} Si 0.0 {0.576327 0.405519 0.414171} Si10 503 0.0 -1 6 {} C 0.0 {0.579994 0.401857 0.374808} C3 504 0.0 -1 7 {} N 0.0 {0.586127 0.440017 0.333466} N 505 0.0 -1 8 {} O 0.0 {0.572832 0.412084 0.335558} O8 506 0.0 -1 8 {} O 0.0 {0.577194 0.41911 0.455494} O9 507 0.0 -1 8 {} O 0.0 {0.599595 0.405929 0.351476} O10 508 0.0 -1 1 {} H 0.0 {0.595498 0.377534 0.434473} H18 509 0.0 -1 1 {} H 0.0 {0.594441 0.358857 0.372883} H19 510 0.0 -1 1 {} H 0.0 {0.227172 0.433761 0.509981} H20 511 0.0 -1 1 {} H 0.0 {0.738036 0.056357 0.626214} H22 512 0.0 -1 1 {} H 0.0 {0.568937 0.419116 0.46056} H24 513 0.0 -1 1 {} H 0.0 {0.590076 0.402101 0.407259} H25 514 0.0 -1 1 {} H 0.0 {0.575632 0.392243 0.378492} H26 515 0.0 -1 1 {} H 0.0 {0.572297 0.408618 0.372923} H27 516 0.0 -1 1 {} H 0.0 {0.588165 0.405475 0.380822} H28 517 0.0 -1 1 {} H 0.0 {0.580749 0.43924 0.324611} H29 518 0.0 -1 1 {} H 0.0 {0.595749 0.436664 0.33144} H31 519 0.0 -1 1 {} H 0.0 {0.221515 0.434966 0.515967} H32 520 0.0 -1 1 {} H 0.0 {0.578223 0.408458 0.449932} H33 521 0.0 -1 1 {} H 0.0 {0.595108 0.417752 0.348033} H34 522 0.0 -1 7 {} N 0.0 {0.577492 0.387471 0.316182} N3 523 0.0 -1 1 {} H 0.0 {0.580704 0.394676 0.310482} H16 524 0.0 -1 1 {} H 0.0 {0.585734 0.381986 0.319159} H17 525 0.0 -1 7 {} N 0.0 {0.590109 0.357717 0.363984} N6 526 0.0 -1 1 {} H 0.0 {0.58039 0.356913 0.366144} H41 527 0.0 -1 1 {} H 0.0 {0.590838 0.36691 0.359318} H42 528 0.0 -1 14 {} Si 0.0 {0.647931 0.611734 0.497621} Si6 529 0.0 -1 8 {} O 0.0 {0.651153 0.627115 0.510125} O6 530 0.0 -1 14 {} Si 0.0 {0.642294 0.631823 0.52338} Si7 531 0.0 -1 8 {} O 0.0 {0.63796 0.646872 0.519578} O7 532 0.0 -1 14 {} Si 0.0 {0.642885 0.659702 0.511668} Si8 533 0.0 -1 7 {} N 0.0 {0.633192 0.672629 0.508815} N2 534 0.0 -1 14 {} Si 0.0 {0.624841 0.675979 0.522359} Si9 535 0.0 -1 14 {} Si 0.0 {0.624207 0.6826 0.498628} Si10 536 0.0 -1 6 {} C 0.0 {0.651867 0.626888 0.492548} C3 537 0.0 -1 7 {} N 0.0 {0.627849 0.624826 0.53236} N 538 0.0 -1 8 {} O 0.0 {0.654824 0.634279 0.533975} O8 539 0.0 -1 8 {} O 0.0 {0.629621 0.60559 0.504606} O9 540 0.0 -1 8 {} O 0.0 {0.657125 0.600311 0.504599} O10 541 0.0 -1 1 {} H 0.0 {0.655242 0.664512 0.518461} H18 542 0.0 -1 1 {} H 0.0 {0.60682 0.647237 0.47563} H19 543 0.0 -1 1 {} H 0.0 {0.658095 0.605112 0.530364} H20 544 0.0 -1 1 {} H 0.0 {0.613678 0.664619 0.527493} H22 545 0.0 -1 1 {} H 0.0 {0.633131 0.683996 0.482477} H24 546 0.0 -1 1 {} H 0.0 {0.613263 0.674993 0.492433} H25 547 0.0 -1 1 {} H 0.0 {0.643969 0.632173 0.487904} H26 548 0.0 -1 1 {} H 0.0 {0.661351 0.627245 0.487744} H27 549 0.0 -1 1 {} H 0.0 {0.635518 0.597797 0.456597} H28 550 0.0 -1 1 {} H 0.0 {0.619313 0.625871 0.526988} H29 551 0.0 -1 1 {} H 0.0 {0.626827 0.630501 0.540938} H31 552 0.0 -1 1 {} H 0.0 {0.659525 0.62558 0.535881} H32 553 0.0 -1 1 {} H 0.0 {0.625935 0.61354 0.510169} H33 554 0.0 -1 1 {} H 0.0 {0.652215 0.593414 0.509644} H34 555 0.0 -1 7 {} N 0.0 {0.631039 0.689823 0.535677} N3 556 0.0 -1 1 {} H 0.0 {0.639794 0.691663 0.530716} H16 557 0.0 -1 1 {} H 0.0 {0.633847 0.68402 0.543278} H17 558 0.0 -1 7 {} N 0.0 {0.187761 0.462857 0.609664} N6 559 0.0 -1 1 {} H 0.0 {0.17981 0.459589 0.615223} H41 560 0.0 -1 1 {} H 0.0 {0.190429 0.471578 0.614394} H42 561 0.0 -1 14 {} Si 0.0 {0.489249 0.379422 0.486774} Si6 562 0.0 -1 8 {} O 0.0 {0.496461 0.371186 0.475023} O6 563 0.0 -1 14 {} Si 0.0 {0.509055 0.372427 0.464555} Si7 564 0.0 -1 8 {} O 0.0 {0.504477 0.384864 0.455792} O7 565 0.0 -1 14 {} Si 0.0 {0.493684 0.391005 0.446545} Si8 566 0.0 -1 7 {} N 0.0 {0.49087 0.383901 0.428734} N2 567 0.0 -1 14 {} Si 0.0 {0.497293 0.388602 0.414077} Si9 568 0.0 -1 14 {} Si 0.0 {0.49159 0.367315 0.427009} Si10 569 0.0 -1 6 {} C 0.0 {0.473363 0.388067 0.483581} C3 570 0.0 -1 7 {} N 0.0 {0.528667 0.369792 0.469214} N 571 0.0 -1 8 {} O 0.0 {0.502787 0.35917 0.456261} O8 572 0.0 -1 8 {} O 0.0 {0.502628 0.385489 0.494037} O9 573 0.0 -1 8 {} O 0.0 {0.487409 0.361698 0.497843} O10 574 0.0 -1 1 {} H 0.0 {0.48107 0.393087 0.453441} H18 575 0.0 -1 1 {} H 0.0 {0.498068 0.404642 0.445196} H19 576 0.0 -1 1 {} H 0.0 {0.512661 0.39475 0.416771} H20 577 0.0 -1 1 {} H 0.0 {0.496454 0.379325 0.401033} H22 578 0.0 -1 1 {} H 0.0 {0.496955 0.362992 0.441256} H24 579 0.0 -1 1 {} H 0.0 {0.504824 0.35837 0.40631} H25 580 0.0 -1 1 {} H 0.0 {0.467685 0.388598 0.492653} H26 581 0.0 -1 1 {} H 0.0 {0.469659 0.382484 0.474811} H27 582 0.0 -1 1 {} H 0.0 {0.475108 0.398742 0.480493} H28 583 0.0 -1 1 {} H 0.0 {0.53027 0.380215 0.468614} H29 584 0.0 -1 1 {} H 0.0 {0.526523 0.368342 0.479325} H31 585 0.0 -1 1 {} H 0.0 {0.510182 0.352885 0.45597} H32 586 0.0 -1 1 {} H 0.0 {0.501178 0.385386 0.503635} H33 587 0.0 -1 1 {} H 0.0 {0.493093 0.356136 0.492225} H34 588 0.0 -1 7 {} N 0.0 {0.488288 0.405886 0.41211} N3 589 0.0 -1 1 {} H 0.0 {0.492129 0.41314 0.417835} H16 590 0.0 -1 1 {} H 0.0 {0.478945 0.402958 0.415611} H17 591 0.0 -1 7 {} N 0.0 {0.474276 0.359023 0.4239} N6 592 0.0 -1 1 {} H 0.0 {0.467698 0.365814 0.428991} H41 593 0.0 -1 1 {} H 0.0 {0.472175 0.361508 0.414187} H42 594 0.0 -1 14 {} Si 0.0 {0.453828 0.629915 0.626538} Si6 595 0.0 -1 8 {} O 0.0 {0.432257 0.645971 0.621594} O6 596 0.0 -1 14 {} Si 0.0 {0.432601 0.636211 0.634029} Si7 597 0.0 -1 8 {} O 0.0 {0.428965 0.623147 0.627201} O7 598 0.0 -1 14 {} Si 0.0 {0.420009 0.615342 0.617137} Si8 599 0.0 -1 7 {} N 0.0 {0.410544 0.622737 0.603512} N2 600 0.0 -1 14 {} Si 0.0 {0.411435 0.639356 0.603954} Si9 601 0.0 -1 14 {} Si 0.0 {0.400511 0.621285 0.590734} Si10 602 0.0 -1 6 {} C 0.0 {0.467108 0.619717 0.641141} C3 603 0.0 -1 7 {} N 0.0 {0.429133 0.644138 0.652144} N 604 0.0 -1 8 {} O 0.0 {0.592531 0.65847 0.272979} O8 605 0.0 -1 8 {} O 0.0 {0.610793 0.661843 0.301841} O9 606 0.0 -1 8 {} O 0.0 {0.585609 0.520227 0.284991} O10 607 0.0 -1 1 {} H 0.0 {0.452976 0.599952 0.629071} H18 608 0.0 -1 1 {} H 0.0 {0.408563 0.608072 0.625853} H19 609 0.0 -1 1 {} H 0.0 {0.397303 0.647155 0.610375} H20 610 0.0 -1 1 {} H 0.0 {0.424633 0.642801 0.615474} H22 611 0.0 -1 1 {} H 0.0 {0.396751 0.636895 0.583967} H24 612 0.0 -1 1 {} H 0.0 {0.389182 0.613092 0.599422} H25 613 0.0 -1 1 {} H 0.0 {0.472286 0.611651 0.636606} H26 614 0.0 -1 1 {} H 0.0 {0.434275 0.608657 0.672198} H27 615 0.0 -1 1 {} H 0.0 {0.47317 0.627375 0.644521} H28 616 0.0 -1 1 {} H 0.0 {0.432123 0.654523 0.650837} H29 617 0.0 -1 1 {} H 0.0 {0.420073 0.643378 0.656269} H31 618 0.0 -1 1 {} H 0.0 {0.588724 0.659254 0.281577} H32 619 0.0 -1 1 {} H 0.0 {0.617275 0.658084 0.308527} H33 620 0.0 -1 1 {} H 0.0 {0.589761 0.528662 0.287472} H34 621 0.0 -1 7 {} N 0.0 {0.421885 0.646728 0.588971} N3 622 0.0 -1 1 {} H 0.0 {0.424668 0.637577 0.585565} H16 623 0.0 -1 1 {} H 0.0 {0.430109 0.649998 0.59364} H17 624 0.0 -1 7 {} N 0.0 {0.410796 0.610292 0.577781} N6 625 0.0 -1 1 {} H 0.0 {0.402832 0.605165 0.574734} H41 626 0.0 -1 1 {} H 0.0 {0.416225 0.604382 0.58317} H42 627 0.0 -1 14 {} Si 0.0 {0.555245 0.588869 0.556271} Si6 628 0.0 -1 8 {} O 0.0 {0.541423 0.597115 0.559496} O6 629 0.0 -1 14 {} Si 0.0 {0.526454 0.598986 0.561921} Si7 630 0.0 -1 8 {} O 0.0 {0.522851 0.584954 0.566799} O7 631 0.0 -1 14 {} Si 0.0 {0.513734 0.57385 0.573543} Si8 632 0.0 -1 7 {} N 0.0 {0.511498 0.557796 0.570009} N2 633 0.0 -1 14 {} Si 0.0 {0.501719 0.544824 0.566296} Si9 634 0.0 -1 14 {} Si 0.0 {0.526969 0.55226 0.570521} Si10 635 0.0 -1 6 {} C 0.0 {0.572557 0.596226 0.555689} C3 636 0.0 -1 7 {} N 0.0 {0.523766 0.613811 0.57155} N 637 0.0 -1 8 {} O 0.0 {0.517251 0.596095 0.543826} O8 638 0.0 -1 8 {} O 0.0 {0.549205 0.583448 0.538318} O9 639 0.0 -1 8 {} O 0.0 {0.550599 0.57534 0.564229} O10 640 0.0 -1 1 {} H 0.0 {0.516555 0.577545 0.588854} H18 641 0.0 -1 1 {} H 0.0 {0.508578 0.55593 0.594905} H19 642 0.0 -1 1 {} H 0.0 {0.484514 0.547933 0.569562} H20 643 0.0 -1 1 {} H 0.0 {0.502215 0.539379 0.553665} H22 644 0.0 -1 1 {} H 0.0 {0.53331 0.550349 0.556953} H24 645 0.0 -1 1 {} H 0.0 {0.497728 0.565501 0.54341} H25 646 0.0 -1 1 {} H 0.0 {0.5731 0.600102 0.545576} H26 647 0.0 -1 1 {} H 0.0 {0.580203 0.588039 0.555448} H27 648 0.0 -1 1 {} H 0.0 {0.574521 0.60469 0.562249} H28 649 0.0 -1 1 {} H 0.0 {0.526367 0.612482 0.581829} H29 650 0.0 -1 1 {} H 0.0 {0.514164 0.616194 0.573511} H31 651 0.0 -1 1 {} H 0.0 {0.519103 0.585905 0.542679} H32 652 0.0 -1 1 {} H 0.0 {0.539596 0.583439 0.540068} H33 653 0.0 -1 1 {} H 0.0 {0.541159 0.57724 0.567594} H34 654 0.0 -1 7 {} N 0.0 {0.505833 0.527717 0.578007} N3 655 0.0 -1 1 {} H 0.0 {0.507003 0.532178 0.587229} H16 656 0.0 -1 1 {} H 0.0 {0.51444 0.52382 0.573971} H17 657 0.0 -1 7 {} N 0.0 {0.536535 0.546632 0.587127} N6 658 0.0 -1 1 {} H 0.0 {0.54402 0.553178 0.588364} H41 659 0.0 -1 1 {} H 0.0 {0.529012 0.55011 0.59393} H42 660 0.0 -1 14 {} Si 0.0 {0.635607 0.447713 0.640217} Si6 661 0.0 -1 8 {} O 0.0 {0.646151 0.447363 0.628987} O6 662 0.0 -1 14 {} Si 0.0 {0.65035 0.440153 0.615702} Si7 663 0.0 -1 8 {} O 0.0 {0.637284 0.434801 0.609581} O7 664 0.0 -1 14 {} Si 0.0 {0.621792 0.432112 0.611076} Si8 665 0.0 -1 7 {} N 0.0 {0.615774 0.416907 0.612723} N2 666 0.0 -1 14 {} Si 0.0 {0.60211 0.405188 0.606623} Si9 667 0.0 -1 14 {} Si 0.0 {0.619917 0.40334 0.626352} Si10 668 0.0 -1 6 {} C 0.0 {0.619876 0.451735 0.637045} C3 669 0.0 -1 7 {} N 0.0 {0.796571 0.425368 0.49846} N 670 0.0 -1 8 {} O 0.0 {0.655644 0.426658 0.621019} O8 671 0.0 -1 8 {} O 0.0 {0.651093 0.458303 0.652093} O9 672 0.0 -1 8 {} O 0.0 {0.641401 0.428708 0.648277} O10 673 0.0 -1 1 {} H 0.0 {0.616671 0.442417 0.623801} H18 674 0.0 -1 1 {} H 0.0 {0.615333 0.437975 0.598118} H19 675 0.0 -1 1 {} H 0.0 {0.604406 0.39182 0.612298} H20 676 0.0 -1 1 {} H 0.0 {0.589492 0.409094 0.61261} H22 677 0.0 -1 1 {} H 0.0 {0.613323 0.407773 0.639174} H24 678 0.0 -1 1 {} H 0.0 {0.650737 0.429981 0.649556} H25 679 0.0 -1 1 {} H 0.0 {0.618511 0.462172 0.634776} H26 680 0.0 -1 1 {} H 0.0 {0.358454 0.258978 0.524168} H27 681 0.0 -1 1 {} H 0.0 {0.615016 0.449729 0.646009} H28 682 0.0 -1 1 {} H 0.0 {0.800022 0.43019 0.489991} H29 683 0.0 -1 1 {} H 0.0 {0.792804 0.416479 0.495487} H31 684 0.0 -1 1 {} H 0.0 {0.648844 0.419925 0.621526} H32 685 0.0 -1 1 {} H 0.0 {0.656816 0.456753 0.643928} H33 686 0.0 -1 1 {} H 0.0 {0.640976 0.423301 0.639051} H34 687 0.0 -1 7 {} N 0.0 {0.602255 0.404975 0.587328} N3 688 0.0 -1 1 {} H 0.0 {0.610263 0.399118 0.584858} H16 689 0.0 -1 1 {} H 0.0 {0.594086 0.3986 0.585407} H17 690 0.0 -1 7 {} N 0.0 {0.638975 0.403007 0.627919} N6 691 0.0 -1 1 {} H 0.0 {0.642426 0.40025 0.618787} H41 692 0.0 -1 1 {} H 0.0 {0.63948 0.393775 0.632966} H42 693 0.0 -1 14 {} Si 0.0 {0.424345 0.290222 0.364737} Si6 694 0.0 -1 8 {} O 0.0 {0.424652 0.288925 0.390693} O6 695 0.0 -1 14 {} Si 0.0 {0.423189 0.296685 0.404499} Si7 696 0.0 -1 8 {} O 0.0 {0.441814 0.273819 0.380021} O7 697 0.0 -1 14 {} Si 0.0 {0.42646 0.275377 0.382199} Si8 698 0.0 -1 7 {} N 0.0 {0.470961 0.253114 0.425844} N2 699 0.0 -1 14 {} Si 0.0 {0.458879 0.278074 0.416754} Si9 700 0.0 -1 14 {} Si 0.0 {0.461709 0.245057 0.436783} Si10 701 0.0 -1 6 {} C 0.0 {0.411408 0.291167 0.355166} C3 702 0.0 -1 7 {} N 0.0 {0.435594 0.311394 0.409572} N 703 0.0 -1 8 {} O 0.0 {0.397823 0.324986 0.408166} O8 704 0.0 -1 8 {} O 0.0 {0.417853 0.274755 0.353676} O9 705 0.0 -1 8 {} O 0.0 {0.37705 0.296678 0.397999} O10 706 0.0 -1 1 {} H 0.0 {0.459279 0.224765 0.474897} H18 707 0.0 -1 1 {} H 0.0 {0.457481 0.275744 0.401677} H19 708 0.0 -1 1 {} H 0.0 {0.453989 0.230337 0.436711} H20 709 0.0 -1 1 {} H 0.0 {0.443227 0.284328 0.428725} H22 710 0.0 -1 1 {} H 0.0 {0.471429 0.243857 0.449437} H24 711 0.0 -1 1 {} H 0.0 {0.467285 0.288426 0.47955} H25 712 0.0 -1 1 {} H 0.0 {0.41099 0.297885 0.346735} H26 713 0.0 -1 1 {} H 0.0 {0.507447 0.339915 0.380676} H27 714 0.0 -1 1 {} H 0.0 {0.402868 0.291189 0.361159} H28 715 0.0 -1 1 {} H 0.0 {0.430297 0.319956 0.411364} H29 716 0.0 -1 1 {} H 0.0 {0.440467 0.311724 0.400201} H31 717 0.0 -1 1 {} H 0.0 {0.393619 0.332314 0.403517} H32 718 0.0 -1 1 {} H 0.0 {0.411743 0.270194 0.359664} H33 719 0.0 -1 1 {} H 0.0 {0.368992 0.301671 0.39584} H34 720 0.0 -1 7 {} N 0.0 {0.471158 0.268207 0.421116} N3 721 0.0 -1 1 {} H 0.0 {0.414832 0.294963 0.438946} H16 722 0.0 -1 1 {} H 0.0 {0.426077 0.270858 0.456007} H17 723 0.0 -1 7 {} N 0.0 {0.493709 0.661026 0.361884} N6 724 0.0 -1 1 {} H 0.0 {0.486729 0.661862 0.369041} H41 725 0.0 -1 1 {} H 0.0 {0.489417 0.655197 0.35428} H42 726 0.0 -1 14 {} Si 0.0 {0.544371 0.240287 0.433826} Si6 727 0.0 -1 8 {} O 0.0 {0.556665 0.233579 0.439637} O6 728 0.0 -1 14 {} Si 0.0 {0.570674 0.237137 0.446055} Si7 729 0.0 -1 8 {} O 0.0 {0.569045 0.23113 0.459916} O7 730 0.0 -1 14 {} Si 0.0 {0.559046 0.225584 0.471076} Si8 731 0.0 -1 7 {} N 0.0 {0.558861 0.235307 0.484365} N2 732 0.0 -1 14 {} Si 0.0 {0.557421 0.250083 0.477107} Si9 733 0.0 -1 14 {} Si 0.0 {0.560845 0.234999 0.500589} Si10 734 0.0 -1 6 {} C 0.0 {0.528629 0.24444 0.442136} C3 735 0.0 -1 7 {} N 0.0 {0.584024 0.230791 0.435546} N 736 0.0 -1 8 {} O 0.0 {0.572797 0.256313 0.45378} O8 737 0.0 -1 8 {} O 0.0 {0.531734 0.218527 0.416811} O9 738 0.0 -1 8 {} O 0.0 {0.552499 0.249402 0.424145} O10 739 0.0 -1 1 {} H 0.0 {0.54639 0.223034 0.465193} H18 740 0.0 -1 1 {} H 0.0 {0.603513 0.347816 0.409643} H19 741 0.0 -1 1 {} H 0.0 {0.542758 0.254277 0.475663} H20 742 0.0 -1 1 {} H 0.0 {0.567554 0.253922 0.463642} H22 743 0.0 -1 1 {} H 0.0 {0.575795 0.236025 0.50577} H24 744 0.0 -1 1 {} H 0.0 {0.556871 0.22207 0.50639} H25 745 0.0 -1 1 {} H 0.0 {0.522555 0.266653 0.452659} H26 746 0.0 -1 1 {} H 0.0 {0.52545 0.2538 0.439412} H27 747 0.0 -1 1 {} H 0.0 {0.520708 0.236989 0.439572} H28 748 0.0 -1 1 {} H 0.0 {0.581572 0.220761 0.435293} H29 749 0.0 -1 1 {} H 0.0 {0.58117 0.233966 0.426327} H31 750 0.0 -1 1 {} H 0.0 {0.565473 0.262302 0.449556} H32 751 0.0 -1 1 {} H 0.0 {0.524514 0.215172 0.422457} H33 752 0.0 -1 1 {} H 0.0 {0.555227 0.2577 0.428541} H34 753 0.0 -1 7 {} N 0.0 {0.581821 0.225756 0.398107} N3 754 0.0 -1 1 {} H 0.0 {0.59201 0.223699 0.396439} H16 755 0.0 -1 1 {} H 0.0 {0.579565 0.223928 0.408345} H17 756 0.0 -1 7 {} N 0.0 {0.553467 0.249926 0.511136} N6 757 0.0 -1 1 {} H 0.0 {0.543554 0.248703 0.510515} H41 758 0.0 -1 1 {} H 0.0 {0.556044 0.246756 0.520654} H42 759 0.0 -1 14 {} Si 0.0 {0.460415 0.301767 0.62562} Si6 760 0.0 -1 8 {} O 0.0 {0.469894 0.289997 0.62968} O6 761 0.0 -1 14 {} Si 0.0 {0.483276 0.281371 0.631682} Si7 762 0.0 -1 8 {} O 0.0 {0.481162 0.280154 0.647422} O7 763 0.0 -1 14 {} Si 0.0 {0.482857 0.27076 0.660064} Si8 764 0.0 -1 7 {} N 0.0 {0.480242 0.276366 0.675219} N2 765 0.0 -1 14 {} Si 0.0 {0.478375 0.295075 0.672842} Si9 766 0.0 -1 14 {} Si 0.0 {0.361301 0.661106 0.49744} Si10 767 0.0 -1 6 {} C 0.0 {0.45807 0.321437 0.636621} C3 768 0.0 -1 7 {} N 0.0 {0.474811 0.232611 0.605425} N 769 0.0 -1 8 {} O 0.0 {0.493107 0.290913 0.614641} O8 770 0.0 -1 8 {} O 0.0 {0.450222 0.293541 0.616313} O9 771 0.0 -1 8 {} O 0.0 {0.468253 0.287838 0.594251} O10 772 0.0 -1 1 {} H 0.0 {0.499344 0.265339 0.660132} H18 773 0.0 -1 1 {} H 0.0 {0.585383 0.278964 0.599989} H19 774 0.0 -1 1 {} H 0.0 {0.515298 0.263706 0.654082} H20 775 0.0 -1 1 {} H 0.0 {0.503125 0.279979 0.684766} H22 776 0.0 -1 1 {} H 0.0 {0.353181 0.67104 0.492669} H24 777 0.0 -1 1 {} H 0.0 {0.36342 0.664541 0.510488} H25 778 0.0 -1 1 {} H 0.0 {0.469204 0.296306 0.59889} H26 779 0.0 -1 1 {} H 0.0 {0.454304 0.319079 0.646491} H27 780 0.0 -1 1 {} H 0.0 {0.468182 0.324413 0.637446} H28 781 0.0 -1 1 {} H 0.0 {0.469319 0.228095 0.612384} H29 782 0.0 -1 1 {} H 0.0 {0.469321 0.238243 0.598651} H31 783 0.0 -1 1 {} H 0.0 {0.485386 0.295332 0.611274} H32 784 0.0 -1 1 {} H 0.0 {0.454794 0.285543 0.611957} H33 785 0.0 -1 1 {} H 0.0 {0.474791 0.281977 0.599843} H34 786 0.0 -1 7 {} N 0.0 {0.498899 0.626216 0.597186} N3 787 0.0 -1 1 {} H 0.0 {0.495894 0.6353 0.60095} H16 788 0.0 -1 1 {} H 0.0 {0.494335 0.619224 0.602938} H17 789 0.0 -1 7 {} N 0.0 {0.355715 0.643475 0.495355} N6 790 0.0 -1 1 {} H 0.0 {0.363361 0.639184 0.490137} H41 791 0.0 -1 1 {} H 0.0 {0.348711 0.644814 0.487992} H42 792 0.0 -1 14 {} Si 0.0 {0.250943 0.428979 0.54475} Si6 793 0.0 -1 8 {} O 0.0 {0.236143 0.424246 0.545762} O6 794 0.0 -1 14 {} Si 0.0 {0.223398 0.41547 0.548462} Si7 795 0.0 -1 8 {} O 0.0 {0.228831 0.401306 0.552568} O7 796 0.0 -1 14 {} Si 0.0 {0.240358 0.392978 0.559207} Si8 797 0.0 -1 7 {} N 0.0 {0.246026 0.394067 0.574651} N2 798 0.0 -1 14 {} Si 0.0 {0.236295 0.400773 0.58615} Si9 799 0.0 -1 14 {} Si 0.0 {0.260553 0.39052 0.586814} Si10 800 0.0 -1 6 {} C 0.0 {0.265866 0.421991 0.553748} C3 801 0.0 -1 7 {} N 0.0 {0.208002 0.425213 0.558721} N 802 0.0 -1 8 {} O 0.0 {0.220053 0.414341 0.533593} O8 803 0.0 -1 8 {} O 0.0 {0.243066 0.429149 0.585129} O9 804 0.0 -1 8 {} O 0.0 {0.250152 0.441975 0.535825} O10 805 0.0 -1 1 {} H 0.0 {0.233413 0.376313 0.558478} H18 806 0.0 -1 1 {} H 0.0 {0.250586 0.390791 0.545721} H19 807 0.0 -1 1 {} H 0.0 {0.236772 0.395501 0.600009} H20 808 0.0 -1 1 {} H 0.0 {0.239939 0.417317 0.585915} H22 809 0.0 -1 1 {} H 0.0 {0.260057 0.389093 0.60113} H24 810 0.0 -1 1 {} H 0.0 {0.272189 0.403556 0.58651} H25 811 0.0 -1 1 {} H 0.0 {0.272724 0.419861 0.546144} H26 812 0.0 -1 1 {} H 0.0 {0.262104 0.413155 0.558242} H27 813 0.0 -1 1 {} H 0.0 {0.270353 0.428424 0.560959} H28 814 0.0 -1 1 {} H 0.0 {0.209257 0.423663 0.568692} H29 815 0.0 -1 1 {} H 0.0 {0.198592 0.421752 0.557673} H31 816 0.0 -1 1 {} H 0.0 {0.221163 0.404335 0.53021} H32 817 0.0 -1 1 {} H 0.0 {0.23513 0.434209 0.588272} H33 818 0.0 -1 1 {} H 0.0 {0.249219 0.432762 0.522438} H34 819 0.0 -1 7 {} N 0.0 {0.218729 0.394056 0.580521} N3 820 0.0 -1 1 {} H 0.0 {0.220677 0.38398 0.581324} H16 821 0.0 -1 1 {} H 0.0 {0.220497 0.397278 0.571183} H17 822 0.0 -1 7 {} N 0.0 {0.269929 0.374916 0.576313} N6 823 0.0 -1 1 {} H 0.0 {0.26415 0.374286 0.568473} H41 824 0.0 -1 1 {} H 0.0 {0.27771 0.375351 0.582964} H42 825 0.0 -1 14 {} Si 0.0 {0.547329 0.414034 0.714382} Si6 826 0.0 -1 8 {} O 0.0 {0.547172 0.408527 0.69973} O6 827 0.0 -1 14 {} Si 0.0 {0.538344 0.40233 0.688749} Si7 828 0.0 -1 8 {} O 0.0 {0.530142 0.415703 0.685121} O7 829 0.0 -1 14 {} Si 0.0 {0.516793 0.419805 0.6782} Si8 830 0.0 -1 7 {} N 0.0 {0.51855 0.42268 0.658872} N2 831 0.0 -1 14 {} Si 0.0 {0.532502 0.43074 0.660317} Si9 832 0.0 -1 14 {} Si 0.0 {0.514334 0.417412 0.644397} Si10 833 0.0 -1 6 {} C 0.0 {0.547018 0.432449 0.71757} C3 834 0.0 -1 7 {} N 0.0 {0.549036 0.390292 0.674034} N 835 0.0 -1 8 {} O 0.0 {0.525794 0.394993 0.696125} O8 836 0.0 -1 8 {} O 0.0 {0.559717 0.400967 0.725198} O9 837 0.0 -1 8 {} O 0.0 {0.533917 0.407094 0.721009} O10 838 0.0 -1 1 {} H 0.0 {0.605783 0.388203 0.693573} H18 839 0.0 -1 1 {} H 0.0 {0.513007 0.434354 0.686279} H19 840 0.0 -1 1 {} H 0.0 {0.582969 0.318573 0.682323} H20 841 0.0 -1 1 {} H 0.0 {0.545297 0.42408 0.660215} H22 842 0.0 -1 1 {} H 0.0 {0.527485 0.408797 0.639539} H24 843 0.0 -1 1 {} H 0.0 {0.513399 0.427557 0.631759} H25 844 0.0 -1 1 {} H 0.0 {0.551396 0.433794 0.72698} H26 845 0.0 -1 1 {} H 0.0 {0.537174 0.436317 0.716834} H27 846 0.0 -1 1 {} H 0.0 {0.553551 0.436784 0.710267} H28 847 0.0 -1 1 {} H 0.0 {0.547252 0.380015 0.675346} H29 848 0.0 -1 1 {} H 0.0 {0.559021 0.391579 0.672874} H31 849 0.0 -1 1 {} H 0.0 {0.524333 0.400243 0.704415} H32 850 0.0 -1 1 {} H 0.0 {0.553752 0.3953 0.72995} H33 851 0.0 -1 1 {} H 0.0 {0.536894 0.399169 0.727305} H34 852 0.0 -1 7 {} N 0.0 {0.533185 0.450221 0.660253} N3 853 0.0 -1 1 {} H 0.0 {0.543239 0.452253 0.65992} H16 854 0.0 -1 1 {} H 0.0 {0.530805 0.451208 0.650048} H17 855 0.0 -1 7 {} N 0.0 {0.499223 0.405838 0.646263} N6 856 0.0 -1 1 {} H 0.0 {0.493358 0.411431 0.65243} H41 857 0.0 -1 1 {} H 0.0 {0.503913 0.39919 0.652375} H42 858 0.0 -1 14 {} Si 0.0 {0.546593 0.321334 0.76758} Si6 859 0.0 -1 8 {} O 0.0 {0.559118 0.322097 0.757139} O6 860 0.0 -1 14 {} Si 0.0 {0.571699 0.315657 0.751462} Si7 861 0.0 -1 8 {} O 0.0 {0.564904 0.304657 0.7425} O7 862 0.0 -1 14 {} Si 0.0 {0.551585 0.299277 0.737007} Si8 863 0.0 -1 7 {} N 0.0 {0.547908 0.288995 0.722004} N2 864 0.0 -1 14 {} Si 0.0 {0.545439 0.35756 0.691334} Si9 865 0.0 -1 14 {} Si 0.0 {0.567528 0.340269 0.718616} Si10 866 0.0 -1 6 {} C 0.0 {0.550273 0.32234 0.785988} C3 867 0.0 -1 7 {} N 0.0 {0.558168 0.346735 0.731018} N 868 0.0 -1 8 {} O 0.0 {0.500022 0.751054 0.518008} O8 869 0.0 -1 8 {} O 0.0 {0.53705 0.309387 0.761663} O9 870 0.0 -1 8 {} O 0.0 {0.537855 0.335007 0.755483} O10 871 0.0 -1 1 {} H 0.0 {0.309498 0.396212 0.362108} H18 872 0.0 -1 1 {} H 0.0 {0.543636 0.312261 0.731021} H19 873 0.0 -1 1 {} H 0.0 {0.550306 0.359616 0.678895} H20 874 0.0 -1 1 {} H 0.0 {0.546511 0.328539 0.726451} H22 875 0.0 -1 1 {} H 0.0 {0.544612 0.390804 0.664681} H24 876 0.0 -1 1 {} H 0.0 {0.562413 0.356473 0.731311} H25 877 0.0 -1 1 {} H 0.0 {0.557167 0.315138 0.787668} H26 878 0.0 -1 1 {} H 0.0 {0.541077 0.321612 0.790358} H27 879 0.0 -1 1 {} H 0.0 {0.554273 0.331667 0.78873} H28 880 0.0 -1 1 {} H 0.0 {0.49919 0.260068 0.573587} H29 881 0.0 -1 1 {} H 0.0 {0.561829 0.341854 0.739221} H31 882 0.0 -1 1 {} H 0.0 {0.577931 0.30734 0.763177} H32 883 0.0 -1 1 {} H 0.0 {0.540327 0.301147 0.748967} H33 884 0.0 -1 1 {} H 0.0 {0.544255 0.334954 0.747869} H34 885 0.0 -1 7 {} N 0.0 {0.529612 0.363607 0.688519} N3 886 0.0 -1 1 {} H 0.0 {0.528462 0.373613 0.690664} H16 887 0.0 -1 1 {} H 0.0 {0.52216 0.35874 0.693387} H17 888 0.0 -1 7 {} N 0.0 {0.604665 0.3977 0.690301} N6 889 0.0 -1 1 {} H 0.0 {0.560867 0.334471 0.70886} H41 890 0.0 -1 1 {} H 0.0 {0.537529 0.392539 0.64047} H42 891 0.0 -1 14 {} Si 0.0 {0.716413 0.45989 0.550185} Si6 892 0.0 -1 8 {} O 0.0 {0.713713 0.473931 0.542915} O6 893 0.0 -1 14 {} Si 0.0 {0.70263 0.483592 0.538227} Si7 894 0.0 -1 8 {} O 0.0 {0.691242 0.481999 0.549899} O7 895 0.0 -1 14 {} Si 0.0 {0.678856 0.476016 0.556863} Si8 896 0.0 -1 7 {} N 0.0 {0.666468 0.487069 0.567974} N2 897 0.0 -1 14 {} Si 0.0 {0.673277 0.500141 0.561199} Si9 898 0.0 -1 14 {} Si 0.0 {0.653454 0.491765 0.575796} Si10 899 0.0 -1 6 {} C 0.0 {0.718243 0.458507 0.569234} C3 900 0.0 -1 7 {} N 0.0 {0.710182 0.501269 0.532458} N 901 0.0 -1 8 {} O 0.0 {0.696748 0.473433 0.527086} O8 902 0.0 -1 8 {} O 0.0 {0.731581 0.455071 0.537698} O9 903 0.0 -1 8 {} O 0.0 {0.706512 0.451408 0.540942} O10 904 0.0 -1 1 {} H 0.0 {0.676043 0.486426 0.48967} H18 905 0.0 -1 1 {} H 0.0 {0.668233 0.472034 0.546471} H19 906 0.0 -1 1 {} H 0.0 {0.526156 0.263415 0.40691} H20 907 0.0 -1 1 {} H 0.0 {0.66624 0.527567 0.587469} H22 908 0.0 -1 1 {} H 0.0 {0.640492 0.487794 0.567258} H24 909 0.0 -1 1 {} H 0.0 {0.649066 0.504522 0.582229} H25 910 0.0 -1 1 {} H 0.0 {0.713258 0.466271 0.574568} H26 911 0.0 -1 1 {} H 0.0 {0.728591 0.459235 0.570852} H27 912 0.0 -1 1 {} H 0.0 {0.714408 0.449251 0.57189} H28 913 0.0 -1 1 {} H 0.0 {0.703826 0.508359 0.536023} H29 914 0.0 -1 1 {} H 0.0 {0.718885 0.503515 0.537249} H31 915 0.0 -1 1 {} H 0.0 {0.700203 0.464118 0.529275} H32 916 0.0 -1 1 {} H 0.0 {0.726586 0.453604 0.527027} H33 917 0.0 -1 1 {} H 0.0 {0.698999 0.449301 0.547135} H34 918 0.0 -1 7 {} N 0.0 {0.535781 0.265413 0.40484} N3 919 0.0 -1 1 {} H 0.0 {0.541919 0.259331 0.410717} H16 920 0.0 -1 1 {} H 0.0 {0.53748 0.275056 0.408045} H17 921 0.0 -1 7 {} N 0.0 {0.267485 0.253647 0.513573} N6 922 0.0 -1 1 {} H 0.0 {0.266862 0.262957 0.516867} H41 923 0.0 -1 1 {} H 0.0 {0.257962 0.250767 0.509574} H42 924 0.0 -1 14 {} Si 0.0 {0.495494 0.481823 0.281958} Si6 925 0.0 -1 8 {} O 0.0 {0.501755 0.469805 0.289054} O6 926 0.0 -1 14 {} Si 0.0 {0.508263 0.459108 0.298805} Si7 927 0.0 -1 8 {} O 0.0 {0.494847 0.45214 0.30355} O7 928 0.0 -1 14 {} Si 0.0 {0.479659 0.455365 0.305167} Si8 929 0.0 -1 7 {} N 0.0 {0.469887 0.454376 0.322199} N2 930 0.0 -1 14 {} Si 0.0 {0.482437 0.458404 0.331263} Si9 931 0.0 -1 14 {} Si 0.0 {0.460976 0.446636 0.33343} Si10 932 0.0 -1 6 {} C 0.0 {0.505049 0.496993 0.280851} C3 933 0.0 -1 7 {} N 0.0 {0.52456 0.458405 0.308468} N 934 0.0 -1 8 {} O 0.0 {0.482716 0.488301 0.329611} O8 935 0.0 -1 8 {} O 0.0 {0.477524 0.481274 0.293783} O9 936 0.0 -1 8 {} O 0.0 {0.488989 0.472995 0.268126} O10 937 0.0 -1 1 {} H 0.0 {0.476952 0.470638 0.298749} H18 938 0.0 -1 1 {} H 0.0 {0.470624 0.444896 0.295947} H19 939 0.0 -1 1 {} H 0.0 {0.495198 0.4497 0.335618} H20 940 0.0 -1 1 {} H 0.0 {0.483494 0.476443 0.330805} H22 941 0.0 -1 1 {} H 0.0 {0.466175 0.430895 0.33563} H24 942 0.0 -1 1 {} H 0.0 {0.444396 0.443957 0.327035} H25 943 0.0 -1 1 {} H 0.0 {0.514628 0.494434 0.276684} H26 944 0.0 -1 1 {} H 0.0 {0.505912 0.502305 0.290248} H27 945 0.0 -1 1 {} H 0.0 {0.499929 0.503177 0.273294} H28 946 0.0 -1 1 {} H 0.0 {0.531679 0.45303 0.30354} H29 947 0.0 -1 1 {} H 0.0 {0.521798 0.453311 0.316629} H31 948 0.0 -1 1 {} H 0.0 {0.485101 0.492156 0.338903} H32 949 0.0 -1 1 {} H 0.0 {0.477017 0.487656 0.30128} H33 950 0.0 -1 1 {} H 0.0 {0.489754 0.4629 0.269997} H34 951 0.0 -1 7 {} N 0.0 {0.509691 0.472783 0.334087} N3 952 0.0 -1 1 {} H 0.0 {0.513816 0.482234 0.331208} H16 953 0.0 -1 1 {} H 0.0 {0.511209 0.474276 0.344298} H17 954 0.0 -1 7 {} N 0.0 {0.459445 0.452909 0.351658} N6 955 0.0 -1 1 {} H 0.0 {0.46488 0.461543 0.350853} H41 956 0.0 -1 1 {} H 0.0 {0.449922 0.456444 0.351711} H42 957 0.0 -1 14 {} Si 0.0 {0.596005 0.683294 0.456438} Si6 958 0.0 -1 8 {} O 0.0 {0.611688 0.682785 0.452728} O6 959 0.0 -1 14 {} Si 0.0 {0.622927 0.674689 0.445295} Si7 960 0.0 -1 8 {} O 0.0 {0.61572 0.66132 0.442393} O7 961 0.0 -1 14 {} Si 0.0 {0.623933 0.657847 0.464621} Si8 962 0.0 -1 7 {} N 0.0 {0.614208 0.654341 0.477279} N2 963 0.0 -1 14 {} Si 0.0 {0.709289 0.343483 0.61032} Si9 964 0.0 -1 14 {} Si 0.0 {0.602052 0.667283 0.486014} Si10 965 0.0 -1 6 {} C 0.0 {0.584824 0.670146 0.459544} C3 966 0.0 -1 7 {} N 0.0 {0.60182 0.231054 0.478808} N 967 0.0 -1 8 {} O 0.0 {0.636899 0.68361 0.470975} O8 968 0.0 -1 8 {} O 0.0 {0.623375 0.68466 0.41848} O9 969 0.0 -1 8 {} O 0.0 {0.592091 0.703263 0.449016} O10 970 0.0 -1 1 {} H 0.0 {0.63707 0.64697 0.46467} H18 971 0.0 -1 1 {} H 0.0 {0.631214 0.673478 0.467408} H19 972 0.0 -1 1 {} H 0.0 {0.70275 0.356342 0.617954} H20 973 0.0 -1 1 {} H 0.0 {0.721274 0.339972 0.617801} H22 974 0.0 -1 1 {} H 0.0 {0.601504 0.681104 0.480989} H24 975 0.0 -1 1 {} H 0.0 {0.59246 0.663897 0.499536} H25 976 0.0 -1 1 {} H 0.0 {0.585008 0.662997 0.451591} H26 977 0.0 -1 1 {} H 0.0 {0.57531 0.674586 0.460178} H27 978 0.0 -1 1 {} H 0.0 {0.589967 0.664064 0.473108} H28 979 0.0 -1 1 {} H 0.0 {0.593397 0.236232 0.478402} H29 980 0.0 -1 1 {} H 0.0 {0.609537 0.238204 0.480668} H31 981 0.0 -1 1 {} H 0.0 {0.630656 0.690496 0.46675} H32 982 0.0 -1 1 {} H 0.0 {0.623547 0.680592 0.429957} H33 983 0.0 -1 1 {} H 0.0 {0.600456 0.707463 0.447145} H34 984 0.0 -1 7 {} N 0.0 {0.696465 0.332235 0.612898} N3 985 0.0 -1 1 {} H 0.0 {0.687575 0.338147 0.614562} H16 986 0.0 -1 1 {} H 0.0 {0.693684 0.328461 0.603491} H17 987 0.0 -1 7 {} N 0.0 {0.329303 0.345189 0.392358} N6 988 0.0 -1 1 {} H 0.0 {0.335137 0.342608 0.384412} H41 989 0.0 -1 1 {} H 0.0 {0.332783 0.352687 0.398272} H42 990 0.0 -1 14 {} Si 0.0 {0.544398 0.642027 0.431006} Si6 991 0.0 -1 8 {} O 0.0 {0.538384 0.640948 0.446017} O6 992 0.0 -1 14 {} Si 0.0 {0.527282 0.645844 0.456448} Si7 993 0.0 -1 8 {} O 0.0 {0.516132 0.634799 0.457153} O7 994 0.0 -1 14 {} Si 0.0 {0.544129 0.640323 0.481549} Si8 995 0.0 -1 7 {} N 0.0 {0.481656 0.66953 0.41835} N2 996 0.0 -1 14 {} Si 0.0 {0.475935 0.662804 0.431986} Si9 997 0.0 -1 14 {} Si 0.0 {0.495678 0.664901 0.412641} Si10 998 0.0 -1 6 {} C 0.0 {0.536872 0.650378 0.416147} C3 999 0.0 -1 7 {} N 0.0 {0.521116 0.664295 0.454193} N 1000 0.0 -1 8 {} O 0.0 {0.537602 0.669603 0.478237} O8 1001 0.0 -1 8 {} O 0.0 {0.550943 0.627026 0.431773} O9 1002 0.0 -1 8 {} O 0.0 {0.55937 0.654899 0.434982} O10 1003 0.0 -1 1 {} H 0.0 {0.535415 0.643479 0.468773} H18 1004 0.0 -1 1 {} H 0.0 {0.531025 0.641867 0.491499} H19 1005 0.0 -1 1 {} H 0.0 {0.485275 0.651851 0.438274} H20 1006 0.0 -1 1 {} H 0.0 {0.608409 0.225638 0.501816} H22 1007 0.0 -1 1 {} H 0.0 {0.506896 0.65304 0.432453} H24 1008 0.0 -1 1 {} H 0.0 {0.510361 0.679225 0.423896} H25 1009 0.0 -1 1 {} H 0.0 {0.528012 0.644389 0.414197} H26 1010 0.0 -1 1 {} H 0.0 {0.544093 0.649815 0.408436} H27 1011 0.0 -1 1 {} H 0.0 {0.53329 0.660706 0.417023} H28 1012 0.0 -1 1 {} H 0.0 {0.524807 0.666551 0.444841} H29 1013 0.0 -1 1 {} H 0.0 {0.511153 0.661765 0.452687} H31 1014 0.0 -1 1 {} H 0.0 {0.537203 0.67946 0.481749} H32 1015 0.0 -1 1 {} H 0.0 {0.560926 0.628148 0.429647} H33 1016 0.0 -1 1 {} H 0.0 {0.567119 0.65026 0.430504} H34 1017 0.0 -1 7 {} N 0.0 {0.477431 0.675374 0.446982} N3 1018 0.0 -1 1 {} H 0.0 {0.467731 0.674299 0.449825} H16 1019 0.0 -1 1 {} H 0.0 {0.477407 0.684072 0.441305} H17 1020 0.0 -1 7 {} N 0.0 {0.491771 0.65771 0.394622} N6 1021 0.0 -1 1 {} H 0.0 {0.495753 0.664943 0.38915} H41 1022 0.0 -1 1 {} H 0.0 {0.483059 0.655391 0.389223} H42 1023 0.0 -1 14 {} Si 0.0 {0.338265 0.494013 0.479815} Si6 1024 0.0 -1 8 {} O 0.0 {0.351382 0.4943 0.48925} O6 1025 0.0 -1 14 {} Si 0.0 {0.365305 0.499899 0.493004} Si7 1026 0.0 -1 8 {} O 0.0 {0.360799 0.509847 0.504127} O7 1027 0.0 -1 14 {} Si 0.0 {0.356232 0.523796 0.509053} Si8 1028 0.0 -1 7 {} N 0.0 {0.361988 0.538153 0.5026} N2 1029 0.0 -1 14 {} Si 0.0 {0.362296 0.552674 0.495359} Si9 1030 0.0 -1 14 {} Si 0.0 {0.377701 0.534194 0.499636} Si10 1031 0.0 -1 6 {} C 0.0 {0.321801 0.501273 0.486644} C3 1032 0.0 -1 7 {} N 0.0 {0.379249 0.484619 0.498776} N 1033 0.0 -1 8 {} O 0.0 {0.370764 0.509336 0.481622} O8 1034 0.0 -1 8 {} O 0.0 {0.338803 0.476641 0.469985} O9 1035 0.0 -1 8 {} O 0.0 {0.34541 0.504136 0.463938} O10 1036 0.0 -1 1 {} H 0.0 {0.338959 0.52168 0.511142} H18 1037 0.0 -1 1 {} H 0.0 {0.36125 0.521991 0.526872} H19 1038 0.0 -1 1 {} H 0.0 {0.35718 0.562197 0.509033} H20 1039 0.0 -1 1 {} H 0.0 {0.376542 0.560745 0.495001} H22 1040 0.0 -1 1 {} H 0.0 {0.364075 0.553358 0.543057} H24 1041 0.0 -1 1 {} H 0.0 {0.376618 0.520857 0.490741} H25 1042 0.0 -1 1 {} H 0.0 {0.314363 0.493733 0.484225} H26 1043 0.0 -1 1 {} H 0.0 {0.320449 0.511411 0.482748} H27 1044 0.0 -1 1 {} H 0.0 {0.322907 0.503059 0.497952} H28 1045 0.0 -1 1 {} H 0.0 {0.373448 0.475513 0.501162} H29 1046 0.0 -1 1 {} H 0.0 {0.384468 0.482786 0.489639} H31 1047 0.0 -1 1 {} H 0.0 {0.36267 0.513607 0.476015} H32 1048 0.0 -1 1 {} H 0.0 {0.345424 0.471818 0.47486} H33 1049 0.0 -1 1 {} H 0.0 {0.340717 0.499375 0.456025} H34 1050 0.0 -1 7 {} N 0.0 {0.354791 0.554316 0.475854} N3 1051 0.0 -1 1 {} H 0.0 {0.348162 0.560933 0.471368} H16 1052 0.0 -1 1 {} H 0.0 {0.349523 0.54551 0.476143} H17 1053 0.0 -1 7 {} N 0.0 {0.390545 0.534788 0.514607} N6 1054 0.0 -1 1 {} H 0.0 {0.394804 0.543875 0.512021} H41 1055 0.0 -1 1 {} H 0.0 {0.383727 0.536937 0.521825} H42 1056 0.0 -1 14 {} Si 0.0 {0.374057 0.446219 0.262469} Si6 1057 0.0 -1 8 {} O 0.0 {0.362249 0.458407 0.252122} O6 1058 0.0 -1 14 {} Si 0.0 {0.370818 0.46902 0.270107} Si7 1059 0.0 -1 8 {} O 0.0 {0.383112 0.475092 0.262547} O7 1060 0.0 -1 14 {} Si 0.0 {0.209018 0.443742 0.551309} Si8 1061 0.0 -1 7 {} N 0.0 {0.208297 0.441424 0.535032} N2 1062 0.0 -1 14 {} Si 0.0 {0.224906 0.453562 0.534788} Si9 1063 0.0 -1 14 {} Si 0.0 {0.46357 0.633197 0.726835} Si10 1064 0.0 -1 6 {} C 0.0 {0.3729 0.433737 0.272621} C3 1065 0.0 -1 7 {} N 0.0 {0.362658 0.472323 0.2879} N 1066 0.0 -1 8 {} O 0.0 {0.406826 0.471187 0.274315} O8 1067 0.0 -1 8 {} O 0.0 {0.645941 0.60391 0.451377} O9 1068 0.0 -1 8 {} O 0.0 {0.369838 0.397685 0.309708} O10 1069 0.0 -1 1 {} H 0.0 {0.429616 0.525123 0.282643} H18 1070 0.0 -1 1 {} H 0.0 {0.199016 0.456483 0.554711} H19 1071 0.0 -1 1 {} H 0.0 {0.224841 0.464407 0.543065} H20 1072 0.0 -1 1 {} H 0.0 {0.239915 0.445926 0.53577} H22 1073 0.0 -1 1 {} H 0.0 {0.467112 0.643111 0.7359} H24 1074 0.0 -1 1 {} H 0.0 {0.459932 0.64072 0.712802} H25 1075 0.0 -1 1 {} H 0.0 {0.70731 0.534079 0.424828} H26 1076 0.0 -1 1 {} H 0.0 {0.379767 0.396265 0.310511} H27 1077 0.0 -1 1 {} H 0.0 {0.711844 0.542443 0.389076} H28 1078 0.0 -1 1 {} H 0.0 {0.362219 0.462648 0.291342} H29 1079 0.0 -1 1 {} H 0.0 {0.37059 0.476243 0.293223} H31 1080 0.0 -1 1 {} H 0.0 {0.417815 0.464444 0.272372} H32 1081 0.0 -1 1 {} H 0.0 {0.653101 0.599692 0.456978} H33 1082 0.0 -1 1 {} H 0.0 {0.367872 0.393372 0.300872} H34 1083 0.0 -1 7 {} N 0.0 {0.224566 0.458051 0.516317} N3 1084 0.0 -1 1 {} H 0.0 {0.215924 0.463199 0.51699} H16 1085 0.0 -1 1 {} H 0.0 {0.232524 0.464198 0.516231} H17 1086 0.0 -1 7 {} N 0.0 {0.451163 0.62394 0.734488} N6 1087 0.0 -1 1 {} H 0.0 {0.4442 0.621255 0.726602} H41 1088 0.0 -1 1 {} H 0.0 {0.454479 0.615639 0.739368} H42 1089 0.0 -1 14 {} Si 0.0 {0.444114 0.332456 0.294511} Si6 1090 0.0 -1 8 {} O 0.0 {0.409538 0.373157 0.308193} O6 1091 0.0 -1 14 {} Si 0.0 {0.413581 0.385028 0.318175} Si7 1092 0.0 -1 8 {} O 0.0 {0.425399 0.389951 0.30957} O7 1093 0.0 -1 14 {} Si 0.0 {0.437949 0.386673 0.300883} Si8 1094 0.0 -1 7 {} N 0.0 {0.430702 0.392808 0.263407} N2 1095 0.0 -1 14 {} Si 0.0 {0.435739 0.402053 0.275199} Si9 1096 0.0 -1 14 {} Si 0.0 {0.416453 0.387558 0.25681} Si10 1097 0.0 -1 6 {} C 0.0 {0.454904 0.345716 0.298097} C3 1098 0.0 -1 7 {} N 0.0 {0.399012 0.396891 0.322876} N 1099 0.0 -1 8 {} O 0.0 {0.421748 0.37871 0.329925} O8 1100 0.0 -1 8 {} O 0.0 {0.445298 0.320746 0.284755} O9 1101 0.0 -1 8 {} O 0.0 {0.463695 0.340751 0.311768} O10 1102 0.0 -1 1 {} H 0.0 {0.403693 0.376079 0.30071} H18 1103 0.0 -1 1 {} H 0.0 {0.437402 0.394922 0.287049} H19 1104 0.0 -1 1 {} H 0.0 {0.418442 0.674604 0.631914} H20 1105 0.0 -1 1 {} H 0.0 {0.428183 0.325704 0.278477} H22 1106 0.0 -1 1 {} H 0.0 {0.404388 0.398131 0.260084} H24 1107 0.0 -1 1 {} H 0.0 {0.461997 0.192725 0.409363} H25 1108 0.0 -1 1 {} H 0.0 {0.460629 0.34849 0.290132} H26 1109 0.0 -1 1 {} H 0.0 {0.448731 0.354409 0.299539} H27 1110 0.0 -1 1 {} H 0.0 {0.452736 0.395109 0.34825} H28 1111 0.0 -1 1 {} H 0.0 {0.391939 0.391014 0.327961} H29 1112 0.0 -1 1 {} H 0.0 {0.404419 0.401922 0.330105} H31 1113 0.0 -1 1 {} H 0.0 {0.476235 0.19291 0.405698} H32 1114 0.0 -1 1 {} H 0.0 {0.453823 0.316118 0.287267} H33 1115 0.0 -1 1 {} H 0.0 {0.430593 0.366942 0.30092} H34 1116 0.0 -1 7 {} N 0.0 {0.506075 0.496573 0.21935} N3 1117 0.0 -1 1 {} H 0.0 {0.456589 0.441572 0.28435} H16 1118 0.0 -1 1 {} H 0.0 {0.424823 0.432217 0.290712} H17 1119 0.0 -1 7 {} N 0.0 {0.409514 0.369218 0.262985} N6 1120 0.0 -1 1 {} H 0.0 {0.418197 0.367713 0.268589} H41 1121 0.0 -1 1 {} H 0.0 {0.402265 0.373303 0.268787} H42 1122 0.0 -1 14 {} Si 0.0 {0.63008 0.484323 0.617034} Si6 1123 0.0 -1 8 {} O 0.0 {0.640312 0.495541 0.62165} O6 1124 0.0 -1 14 {} Si 0.0 {0.64411 0.510357 0.619678} Si7 1125 0.0 -1 8 {} O 0.0 {0.630293 0.517686 0.623802} O7 1126 0.0 -1 14 {} Si 0.0 {0.614923 0.519453 0.61967} Si8 1127 0.0 -1 7 {} N 0.0 {0.608864 0.532014 0.610681} N2 1128 0.0 -1 14 {} Si 0.0 {0.61974 0.54433 0.608945} Si9 1129 0.0 -1 14 {} Si 0.0 {0.59605 0.537969 0.602509} Si10 1130 0.0 -1 6 {} C 0.0 {0.335842 0.58638 0.305569} C3 1131 0.0 -1 7 {} N 0.0 {0.66077 0.516777 0.627448} N 1132 0.0 -1 8 {} O 0.0 {0.614495 0.491301 0.606816} O8 1133 0.0 -1 8 {} O 0.0 {0.637547 0.473304 0.610325} O9 1134 0.0 -1 8 {} O 0.0 {0.623033 0.4805 0.630992} O10 1135 0.0 -1 1 {} H 0.0 {0.612463 0.5052 0.60981} H18 1136 0.0 -1 1 {} H 0.0 {0.606217 0.515274 0.63409} H19 1137 0.0 -1 1 {} H 0.0 {0.605515 0.554223 0.616382} H20 1138 0.0 -1 1 {} H 0.0 {0.426717 0.13376 0.784497} H22 1139 0.0 -1 1 {} H 0.0 {0.599023 0.52292 0.5924} H24 1140 0.0 -1 1 {} H 0.0 {0.59645 0.548297 0.592505} H25 1141 0.0 -1 1 {} H 0.0 {0.329762 0.592128 0.299631} H26 1142 0.0 -1 1 {} H 0.0 {0.335414 0.591399 0.314786} H27 1143 0.0 -1 1 {} H 0.0 {0.331367 0.577028 0.306473} H28 1144 0.0 -1 1 {} H 0.0 {0.665089 0.507597 0.628462} H29 1145 0.0 -1 1 {} H 0.0 {0.657754 0.51863 0.637552} H31 1146 0.0 -1 1 {} H 0.0 {0.618334 0.493145 0.597457} H32 1147 0.0 -1 1 {} H 0.0 {0.64128 0.466217 0.616227} H33 1148 0.0 -1 1 {} H 0.0 {0.628171 0.483614 0.638265} H34 1149 0.0 -1 7 {} N 0.0 {0.626996 0.548724 0.590168} N3 1150 0.0 -1 1 {} H 0.0 {0.635631 0.544292 0.589955} H16 1151 0.0 -1 1 {} H 0.0 {0.621274 0.542322 0.585031} H17 1152 0.0 -1 7 {} N 0.0 {0.580691 0.537309 0.61467} N6 1153 0.0 -1 1 {} H 0.0 {0.585632 0.533939 0.622657} H41 1154 0.0 -1 1 {} H 0.0 {0.579799 0.547569 0.616118} H42 1155 0.0 -1 14 {} Si 0.0 {0.291232 0.481611 0.526019} Si6 1156 0.0 -1 8 {} O 0.0 {0.295421 0.485532 0.540832} O6 1157 0.0 -1 14 {} Si 0.0 {0.30544 0.478205 0.550006} Si7 1158 0.0 -1 8 {} O 0.0 {0.294878 0.476293 0.561826} O7 1159 0.0 -1 14 {} Si 0.0 {0.293265 0.47867 0.578071} Si8 1160 0.0 -1 7 {} N 0.0 {0.295065 0.4629 0.589488} N2 1161 0.0 -1 14 {} Si 0.0 {0.299824 0.456789 0.603703} Si9 1162 0.0 -1 14 {} Si 0.0 {0.268091 0.488438 0.530924} Si10 1163 0.0 -1 6 {} C 0.0 {0.296336 0.49171 0.511283} C3 1164 0.0 -1 7 {} N 0.0 {0.317024 0.464393 0.545645} N 1165 0.0 -1 8 {} O 0.0 {0.32535 0.467139 0.514983} O8 1166 0.0 -1 8 {} O 0.0 {0.292797 0.459875 0.528826} O9 1167 0.0 -1 8 {} O 0.0 {0.314596 0.44641 0.569483} O10 1168 0.0 -1 1 {} H 0.0 {0.310117 0.486901 0.59363} H18 1169 0.0 -1 1 {} H 0.0 {0.278291 0.483357 0.578817} H19 1170 0.0 -1 1 {} H 0.0 {0.295197 0.441738 0.605038} H20 1171 0.0 -1 1 {} H 0.0 {0.316029 0.459721 0.606786} H22 1172 0.0 -1 1 {} H 0.0 {0.29583 0.454882 0.520796} H24 1173 0.0 -1 1 {} H 0.0 {0.318044 0.461895 0.510811} H25 1174 0.0 -1 1 {} H 0.0 {0.288237 0.497858 0.506646} H26 1175 0.0 -1 1 {} H 0.0 {0.299386 0.485218 0.503803} H27 1176 0.0 -1 1 {} H 0.0 {0.303956 0.4985 0.514493} H28 1177 0.0 -1 1 {} H 0.0 {0.318628 0.46534 0.535574} H29 1178 0.0 -1 1 {} H 0.0 {0.326819 0.466333 0.548715} H31 1179 0.0 -1 1 {} H 0.0 {0.333186 0.465828 0.508002} H32 1180 0.0 -1 1 {} H 0.0 {0.299848 0.457835 0.534741} H33 1181 0.0 -1 1 {} H 0.0 {0.312655 0.450689 0.560717} H34 1182 0.0 -1 7 {} N 0.0 {0.290937 0.462579 0.616829} N3 1183 0.0 -1 1 {} H 0.0 {0.290958 0.472753 0.616666} H16 1184 0.0 -1 1 {} H 0.0 {0.281028 0.46059 0.615543} H17 1185 0.0 -1 7 {} N 0.0 {0.260066 0.485034 0.546943} N6 1186 0.0 -1 1 {} H 0.0 {0.262612 0.475385 0.548886} H41 1187 0.0 -1 1 {} H 0.0 {0.249987 0.485357 0.544986} H42 1188 0.0 -1 14 {} Si 0.0 {0.454331 0.406825 0.330811} Si6 1189 0.0 -1 8 {} O 0.0 {0.459313 0.395178 0.340835} O6 1190 0.0 -1 14 {} Si 0.0 {0.395761 0.407637 0.279636} Si7 1191 0.0 -1 8 {} O 0.0 {0.405791 0.418947 0.28224} O7 1192 0.0 -1 14 {} Si 0.0 {0.419852 0.424886 0.279764} Si8 1193 0.0 -1 7 {} N 0.0 {0.486544 0.513035 0.208508} N2 1194 0.0 -1 14 {} Si 0.0 {0.491571 0.504864 0.22078} Si9 1195 0.0 -1 14 {} Si 0.0 {0.373104 0.420019 0.282566} Si10 1196 0.0 -1 6 {} C 0.0 {0.436526 0.413594 0.330203} C3 1197 0.0 -1 7 {} N 0.0 {0.397742 0.39156 0.286159} N 1198 0.0 -1 8 {} O 0.0 {0.393788 0.408157 0.263714} O8 1199 0.0 -1 8 {} O 0.0 {0.462743 0.398236 0.316666} O9 1200 0.0 -1 8 {} O 0.0 {0.46692 0.416203 0.333254} O10 1201 0.0 -1 1 {} H 0.0 {0.42795 0.41269 0.277276} H18 1202 0.0 -1 1 {} H 0.0 {0.375024 0.402696 0.255692} H19 1203 0.0 -1 1 {} H 0.0 {0.492802 0.512845 0.233371} H20 1204 0.0 -1 1 {} H 0.0 {0.480011 0.492655 0.225398} H22 1205 0.0 -1 1 {} H 0.0 {0.342671 0.381567 0.271331} H24 1206 0.0 -1 1 {} H 0.0 {0.486225 0.68426 0.387589} H25 1207 0.0 -1 1 {} H 0.0 {0.434312 0.416346 0.319954} H26 1208 0.0 -1 1 {} H 0.0 {0.437514 0.421906 0.336572} H27 1209 0.0 -1 1 {} H 0.0 {0.429353 0.407161 0.333718} H28 1210 0.0 -1 1 {} H 0.0 {0.403921 0.385848 0.28008} H29 1211 0.0 -1 1 {} H 0.0 {0.403546 0.393236 0.295133} H31 1212 0.0 -1 1 {} H 0.0 {0.398784 0.416703 0.259658} H32 1213 0.0 -1 1 {} H 0.0 {0.465697 0.38971 0.321002} H33 1214 0.0 -1 1 {} H 0.0 {0.4746 0.413913 0.325212} H34 1215 0.0 -1 7 {} N 0.0 {0.507095 0.485467 0.230294} N3 1216 0.0 -1 1 {} H 0.0 {0.498481 0.479183 0.230553} H16 1217 0.0 -1 1 {} H 0.0 {0.51438 0.47854 0.228134} H17 1218 0.0 -1 7 {} N 0.0 {0.497608 0.451467 0.79941} N6 1219 0.0 -1 1 {} H 0.0 {0.490498 0.459613 0.799932} H41 1220 0.0 -1 1 {} H 0.0 {0.50676 0.456086 0.799735} H42 1221 0.0 -1 14 {} Si 0.0 {0.533629 0.306746 0.47156} Si6 1222 0.0 -1 8 {} O 0.0 {0.543602 0.331252 0.482631} O6 1223 0.0 -1 14 {} Si 0.0 {0.528387 0.32739 0.484334} Si7 1224 0.0 -1 8 {} O 0.0 {0.554934 0.351411 0.478527} O7 1225 0.0 -1 14 {} Si 0.0 {0.555655 0.341064 0.489824} Si8 1226 0.0 -1 7 {} N 0.0 {0.546106 0.379483 0.423959} N2 1227 0.0 -1 14 {} Si 0.0 {0.576873 0.353566 0.412494} Si9 1228 0.0 -1 14 {} Si 0.0 {0.628381 0.344215 0.467951} Si10 1229 0.0 -1 6 {} C 0.0 {0.5384 0.291532 0.481464} C3 1230 0.0 -1 7 {} N 0.0 {0.51524 0.337689 0.478002} N 1231 0.0 -1 8 {} O 0.0 {0.531197 0.318761 0.49727} O8 1232 0.0 -1 8 {} O 0.0 {0.529049 0.341636 0.453676} O9 1233 0.0 -1 8 {} O 0.0 {0.518382 0.310068 0.469769} O10 1234 0.0 -1 1 {} H 0.0 {0.626307 0.293287 0.465862} H18 1235 0.0 -1 1 {} H 0.0 {0.534292 0.333518 0.453825} H19 1236 0.0 -1 1 {} H 0.0 {0.580094 0.235828 0.396577} H20 1237 0.0 -1 1 {} H 0.0 {0.518747 0.373885 0.355909} H22 1238 0.0 -1 1 {} H 0.0 {0.614663 0.344199 0.475979} H24 1239 0.0 -1 1 {} H 0.0 {0.578516 0.342199 0.449017} H25 1240 0.0 -1 1 {} H 0.0 {0.544609 0.294005 0.490314} H26 1241 0.0 -1 1 {} H 0.0 {0.543461 0.284574 0.474876} H27 1242 0.0 -1 1 {} H 0.0 {0.528409 0.288214 0.484276} H28 1243 0.0 -1 1 {} H 0.0 {0.518719 0.344797 0.471648} H29 1244 0.0 -1 1 {} H 0.0 {0.509171 0.33192 0.472238} H31 1245 0.0 -1 1 {} H 0.0 {0.524936 0.321867 0.50404} H32 1246 0.0 -1 1 {} H 0.0 {0.530617 0.345738 0.444284} H33 1247 0.0 -1 1 {} H 0.0 {0.515437 0.306252 0.461215} H34 1248 0.0 -1 7 {} N 0.0 {0.571855 0.365883 0.423187} N3 1249 0.0 -1 1 {} H 0.0 {0.578694 0.36671 0.430964} H16 1250 0.0 -1 1 {} H 0.0 {0.563637 0.362273 0.428139} H17 1251 0.0 -1 7 {} N 0.0 {0.603352 0.479149 0.798732} N6 1252 0.0 -1 1 {} H 0.0 {0.593908 0.480075 0.793316} H41 1253 0.0 -1 1 {} H 0.0 {0.609815 0.475257 0.791584} H42 1254 0.0 -1 14 {} Si 0.0 {0.53138 0.567406 0.356397} Si6 1255 0.0 -1 8 {} O 0.0 {0.546217 0.569546 0.352173} O6 1256 0.0 -1 14 {} Si 0.0 {0.561734 0.56737 0.356754} Si7 1257 0.0 -1 8 {} O 0.0 {0.570866 0.565237 0.337198} O7 1258 0.0 -1 14 {} Si 0.0 {0.56637 0.549998 0.336575} Si8 1259 0.0 -1 7 {} N 0.0 {0.574218 0.531753 0.335254} N2 1260 0.0 -1 14 {} Si 0.0 {0.569734 0.518871 0.345116} Si9 1261 0.0 -1 14 {} Si 0.0 {0.579895 0.522947 0.32214} Si10 1262 0.0 -1 6 {} C 0.0 {0.525499 0.579475 0.374541} C3 1263 0.0 -1 7 {} N 0.0 {0.571868 0.578854 0.370393} N 1264 0.0 -1 8 {} O 0.0 {0.561825 0.553173 0.363889} O8 1265 0.0 -1 8 {} O 0.0 {0.532712 0.5632 0.374614} O9 1266 0.0 -1 8 {} O 0.0 {0.527799 0.548241 0.350952} O10 1267 0.0 -1 1 {} H 0.0 {0.558287 0.546291 0.349094} H18 1268 0.0 -1 1 {} H 0.0 {0.554636 0.549771 0.328626} H19 1269 0.0 -1 1 {} H 0.0 {0.553008 0.517199 0.340804} H20 1270 0.0 -1 1 {} H 0.0 {0.571952 0.505886 0.346669} H22 1271 0.0 -1 1 {} H 0.0 {0.569038 0.513886 0.314909} H24 1272 0.0 -1 1 {} H 0.0 {0.591459 0.51499 0.323701} H25 1273 0.0 -1 1 {} H 0.0 {0.532969 0.583795 0.381433} H26 1274 0.0 -1 1 {} H 0.0 {0.515796 0.579065 0.378838} H27 1275 0.0 -1 1 {} H 0.0 {0.525126 0.587058 0.367415} H28 1276 0.0 -1 1 {} H 0.0 {0.578333 0.571117 0.372645} H29 1277 0.0 -1 1 {} H 0.0 {0.578034 0.587129 0.372743} H31 1278 0.0 -1 1 {} H 0.0 {0.553146 0.550221 0.365886} H32 1279 0.0 -1 1 {} H 0.0 {0.524462 0.557688 0.376984} H33 1280 0.0 -1 1 {} H 0.0 {0.531177 0.544257 0.359186} H34 1281 0.0 -1 7 {} N 0.0 {0.571903 0.523029 0.363945} N3 1282 0.0 -1 1 {} H 0.0 {0.574322 0.533314 0.363977} H16 1283 0.0 -1 1 {} H 0.0 {0.579978 0.516243 0.364825} H17 1284 0.0 -1 7 {} N 0.0 {0.585592 0.536577 0.309229} N6 1285 0.0 -1 1 {} H 0.0 {0.595002 0.53518 0.309161} H41 1286 0.0 -1 1 {} H 0.0 {0.583679 0.544487 0.315169} H42 1287 0.0 -1 14 {} Si 0.0 {0.419801 0.217223 0.556447} Si6 1288 0.0 -1 8 {} O 0.0 {0.434973 0.221822 0.556851} O6 1289 0.0 -1 14 {} Si 0.0 {0.450896 0.219937 0.555271} Si7 1290 0.0 -1 8 {} O 0.0 {0.448186 0.211842 0.542042} O7 1291 0.0 -1 14 {} Si 0.0 {0.442929 0.214281 0.527552} Si8 1292 0.0 -1 7 {} N 0.0 {0.451609 0.205468 0.512374} N2 1293 0.0 -1 14 {} Si 0.0 {0.467119 0.207641 0.517693} Si9 1294 0.0 -1 14 {} Si 0.0 {0.449919 0.198937 0.497551} Si10 1295 0.0 -1 6 {} C 0.0 {0.408445 0.230103 0.552393} C3 1296 0.0 -1 7 {} N 0.0 {0.46023 0.211852 0.569946} N 1297 0.0 -1 8 {} O 0.0 {0.416977 0.202226 0.529583} O8 1298 0.0 -1 8 {} O 0.0 {0.450527 0.247718 0.531049} O9 1299 0.0 -1 8 {} O 0.0 {0.418725 0.206577 0.568255} O10 1300 0.0 -1 1 {} H 0.0 {0.427278 0.206742 0.526781} H18 1301 0.0 -1 1 {} H 0.0 {0.441434 0.2289 0.524628} H19 1302 0.0 -1 1 {} H 0.0 {0.475808 0.195289 0.522291} H20 1303 0.0 -1 1 {} H 0.0 {0.474631 0.210064 0.501725} H22 1304 0.0 -1 1 {} H 0.0 {0.420638 0.228479 0.496906} H24 1305 0.0 -1 1 {} H 0.0 {0.396323 0.199376 0.503382} H25 1306 0.0 -1 1 {} H 0.0 {0.412277 0.23936 0.555554} H26 1307 0.0 -1 1 {} H 0.0 {0.315955 0.225451 0.553374} H27 1308 0.0 -1 1 {} H 0.0 {0.407503 0.230253 0.541396} H28 1309 0.0 -1 1 {} H 0.0 {0.414908 0.286026 0.58604} H29 1310 0.0 -1 1 {} H 0.0 {0.460243 0.219426 0.577058} H31 1311 0.0 -1 1 {} H 0.0 {0.416906 0.206516 0.541122} H32 1312 0.0 -1 1 {} H 0.0 {0.457513 0.243493 0.526567} H33 1313 0.0 -1 1 {} H 0.0 {0.428114 0.203771 0.57021} H34 1314 0.0 -1 7 {} N 0.0 {0.472824 0.226188 0.519093} N3 1315 0.0 -1 1 {} H 0.0 {0.482418 0.226665 0.515798} H16 1316 0.0 -1 1 {} H 0.0 {0.473257 0.226635 0.529451} H17 1317 0.0 -1 7 {} N 0.0 {0.43168 0.197536 0.490916} N6 1318 0.0 -1 1 {} H 0.0 {0.426264 0.194846 0.49968} H41 1319 0.0 -1 1 {} H 0.0 {0.429683 0.207227 0.489812} H42 1320 0.0 -1 14 {} Si 0.0 {0.404139 0.59638 0.423619} Si6 1321 0.0 -1 8 {} O 0.0 {0.41373 0.600648 0.435061} O6 1322 0.0 -1 14 {} Si 0.0 {0.42588 0.603235 0.44383} Si7 1323 0.0 -1 8 {} O 0.0 {0.437409 0.604522 0.433801} O7 1324 0.0 -1 14 {} Si 0.0 {0.446777 0.597124 0.424316} Si8 1325 0.0 -1 7 {} N 0.0 {0.463112 0.588059 0.429291} N2 1326 0.0 -1 14 {} Si 0.0 {0.458942 0.580793 0.443152} Si9 1327 0.0 -1 14 {} Si 0.0 {0.476205 0.580054 0.423219} Si10 1328 0.0 -1 6 {} C 0.0 {0.386149 0.599087 0.424726} C3 1329 0.0 -1 7 {} N 0.0 {0.424977 0.612106 0.460214} N 1330 0.0 -1 8 {} O 0.0 {0.429284 0.583936 0.449268} O8 1331 0.0 -1 8 {} O 0.0 {0.413355 0.577692 0.424513} O9 1332 0.0 -1 8 {} O 0.0 {0.413664 0.598515 0.409859} O10 1333 0.0 -1 1 {} H 0.0 {0.43937 0.588431 0.415748} H18 1334 0.0 -1 1 {} H 0.0 {0.452183 0.611453 0.415501} H19 1335 0.0 -1 1 {} H 0.0 {0.442628 0.582533 0.446509} H20 1336 0.0 -1 1 {} H 0.0 {0.458293 0.565472 0.44252} H22 1337 0.0 -1 1 {} H 0.0 {0.470666 0.570172 0.411127} H24 1338 0.0 -1 1 {} H 0.0 {0.48386 0.569476 0.43493} H25 1339 0.0 -1 1 {} H 0.0 {0.383151 0.590807 0.431633} H26 1340 0.0 -1 1 {} H 0.0 {0.382448 0.598343 0.413921} H27 1341 0.0 -1 1 {} H 0.0 {0.384323 0.609236 0.428228} H28 1342 0.0 -1 1 {} H 0.0 {0.415776 0.611427 0.46472} H29 1343 0.0 -1 1 {} H 0.0 {0.429672 0.604483 0.465537} H31 1344 0.0 -1 1 {} H 0.0 {0.425441 0.579632 0.441951} H32 1345 0.0 -1 1 {} H 0.0 {0.416949 0.576868 0.415019} H33 1346 0.0 -1 1 {} H 0.0 {0.415791 0.608098 0.409238} H34 1347 0.0 -1 7 {} N 0.0 {0.466994 0.586089 0.457856} N3 1348 0.0 -1 1 {} H 0.0 {0.476991 0.583177 0.458292} H16 1349 0.0 -1 1 {} H 0.0 {0.467302 0.596426 0.455448} H17 1350 0.0 -1 7 {} N 0.0 {0.491616 0.590375 0.42209} N6 1351 0.0 -1 1 {} H 0.0 {0.49048 0.597981 0.415551} H41 1352 0.0 -1 1 {} H 0.0 {0.492685 0.594815 0.431085} H42 1353 0.0 -1 14 {} Si 0.0 {0.664841 0.420142 0.457917} Si6 1354 0.0 -1 8 {} O 0.0 {0.650369 0.414763 0.457277} O6 1355 0.0 -1 14 {} Si 0.0 {0.638604 0.405101 0.457458} Si7 1356 0.0 -1 8 {} O 0.0 {0.63814 0.403677 0.473147} O7 1357 0.0 -1 14 {} Si 0.0 {0.64042 0.394838 0.486095} Si8 1358 0.0 -1 7 {} N 0.0 {0.655045 0.388317 0.490848} N2 1359 0.0 -1 14 {} Si 0.0 {0.66481 0.384244 0.478301} Si9 1360 0.0 -1 14 {} Si 0.0 {0.665471 0.384891 0.503287} Si10 1361 0.0 -1 6 {} C 0.0 {0.67167 0.426151 0.474129} C3 1362 0.0 -1 7 {} N 0.0 {0.624509 0.404521 0.447019} N 1363 0.0 -1 8 {} O 0.0 {0.648183 0.38648 0.452621} O8 1364 0.0 -1 8 {} O 0.0 {0.66625 0.425351 0.443019} O9 1365 0.0 -1 8 {} O 0.0 {0.677695 0.403787 0.461998} O10 1366 0.0 -1 1 {} H 0.0 {0.635057 0.402922 0.501988} H18 1367 0.0 -1 1 {} H 0.0 {0.628432 0.383187 0.484668} H19 1368 0.0 -1 1 {} H 0.0 {0.614845 0.372914 0.489713} H20 1369 0.0 -1 1 {} H 0.0 {0.654332 0.385723 0.462313} H22 1370 0.0 -1 1 {} H 0.0 {0.662703 0.399334 0.509716} H24 1371 0.0 -1 1 {} H 0.0 {0.681398 0.389425 0.501392} H25 1372 0.0 -1 1 {} H 0.0 {0.681318 0.429649 0.473152} H26 1373 0.0 -1 1 {} H 0.0 {0.669664 0.419066 0.482683} H27 1374 0.0 -1 1 {} H 0.0 {0.666259 0.435057 0.476181} H28 1375 0.0 -1 1 {} H 0.0 {0.620701 0.395064 0.447011} H29 1376 0.0 -1 1 {} H 0.0 {0.617324 0.409555 0.45209} H31 1377 0.0 -1 1 {} H 0.0 {0.65599 0.389082 0.446524} H32 1378 0.0 -1 1 {} H 0.0 {0.672188 0.420185 0.438473} H33 1379 0.0 -1 1 {} H 0.0 {0.675221 0.39692 0.454936} H34 1380 0.0 -1 7 {} N 0.0 {0.664887 0.365557 0.471754} N3 1381 0.0 -1 1 {} H 0.0 {0.65565 0.362305 0.474581} H16 1382 0.0 -1 1 {} H 0.0 {0.665289 0.365675 0.461822} H17 1383 0.0 -1 7 {} N 0.0 {0.660027 0.368616 0.513385} N6 1384 0.0 -1 1 {} H 0.0 {0.669177 0.365956 0.515508} H41 1385 0.0 -1 1 {} H 0.0 {0.656722 0.363915 0.504864} H42 1386 0.0 -1 14 {} Si 0.0 {0.718487 0.370348 0.482346} Si6 1387 0.0 -1 8 {} O 0.0 {0.712017 0.371858 0.495848} O6 1388 0.0 -1 14 {} Si 0.0 {0.702733 0.374734 0.507808} Si7 1389 0.0 -1 8 {} O 0.0 {0.691089 0.364602 0.50342} O7 1390 0.0 -1 14 {} Si 0.0 {0.686689 0.353807 0.494048} Si8 1391 0.0 -1 7 {} N 0.0 {0.679502 0.339223 0.498358} N2 1392 0.0 -1 14 {} Si 0.0 {0.684375 0.329779 0.514821} Si9 1393 0.0 -1 14 {} Si 0.0 {0.665007 0.330146 0.496613} Si10 1394 0.0 -1 6 {} C 0.0 {0.736968 0.373599 0.481121} C3 1395 0.0 -1 7 {} N 0.0 {0.71197 0.373898 0.525} N 1396 0.0 -1 8 {} O 0.0 {0.695494 0.389768 0.498566} O8 1397 0.0 -1 8 {} O 0.0 {0.707551 0.37822 0.474367} O9 1398 0.0 -1 8 {} O 0.0 {0.709646 0.352063 0.477417} O10 1399 0.0 -1 1 {} H 0.0 {0.675892 0.359116 0.483562} H18 1400 0.0 -1 1 {} H 0.0 {0.700154 0.352389 0.48469} H19 1401 0.0 -1 1 {} H 0.0 {0.684621 0.313655 0.506} H20 1402 0.0 -1 1 {} H 0.0 {0.697533 0.334239 0.517865} H22 1403 0.0 -1 1 {} H 0.0 {0.660545 0.325021 0.509638} H24 1404 0.0 -1 1 {} H 0.0 {0.666868 0.316039 0.489698} H25 1405 0.0 -1 1 {} H 0.0 {0.739483 0.37815 0.490554} H26 1406 0.0 -1 1 {} H 0.0 {0.738409 0.379798 0.472791} H27 1407 0.0 -1 1 {} H 0.0 {0.741688 0.363119 0.479902} H28 1408 0.0 -1 1 {} H 0.0 {0.717781 0.365245 0.523966} H29 1409 0.0 -1 1 {} H 0.0 {0.704622 0.370765 0.531464} H31 1410 0.0 -1 1 {} H 0.0 {0.695984 0.38716 0.488923} H32 1411 0.0 -1 1 {} H 0.0 {0.703984 0.372462 0.467511} H33 1412 0.0 -1 1 {} H 0.0 {0.705193 0.353741 0.468718} H34 1413 0.0 -1 7 {} N 0.0 {0.675038 0.337538 0.529514} N3 1414 0.0 -1 1 {} H 0.0 {0.666019 0.332827 0.529254} H16 1415 0.0 -1 1 {} H 0.0 {0.672549 0.346474 0.525272} H17 1416 0.0 -1 7 {} N 0.0 {0.649627 0.341616 0.496613} N6 1417 0.0 -1 1 {} H 0.0 {0.654027 0.350237 0.496409} H41 1418 0.0 -1 1 {} H 0.0 {0.646426 0.340212 0.487048} H42 1419 0.0 -1 14 {} Si 0.0 {0.374142 0.365951 0.597185} Si6 1420 0.0 -1 8 {} O 0.0 {0.371535 0.378129 0.586933} O6 1421 0.0 -1 14 {} Si 0.0 {0.363346 0.392147 0.584103} Si7 1422 0.0 -1 8 {} O 0.0 {0.408218 0.343478 0.560279} O7 1423 0.0 -1 14 {} Si 0.0 {0.351182 0.373892 0.574274} Si8 1424 0.0 -1 7 {} N 0.0 {0.383237 0.395285 0.668616} N2 1425 0.0 -1 14 {} Si 0.0 {0.371917 0.388178 0.676974} Si9 1426 0.0 -1 14 {} Si 0.0 {0.387061 0.393328 0.653373} Si10 1427 0.0 -1 6 {} C 0.0 {0.367814 0.348381 0.597051} C3 1428 0.0 -1 7 {} N 0.0 {0.41138 0.260588 0.383518} N 1429 0.0 -1 8 {} O 0.0 {0.308061 0.352316 0.550533} O8 1430 0.0 -1 8 {} O 0.0 {0.359721 0.382239 0.543471} O9 1431 0.0 -1 8 {} O 0.0 {0.344652 0.383429 0.585371} O10 1432 0.0 -1 1 {} H 0.0 {0.345544 0.391513 0.297818} H18 1433 0.0 -1 1 {} H 0.0 {0.261228 0.381602 0.626807} H19 1434 0.0 -1 1 {} H 0.0 {0.371249 0.372914 0.673794} H20 1435 0.0 -1 1 {} H 0.0 {0.351511 0.405913 0.627056} H22 1436 0.0 -1 1 {} H 0.0 {0.396346 0.406311 0.648232} H24 1437 0.0 -1 1 {} H 0.0 {0.374871 0.392815 0.643895} H25 1438 0.0 -1 1 {} H 0.0 {0.361024 0.347752 0.589043} H26 1439 0.0 -1 1 {} H 0.0 {0.361972 0.346679 0.605895} H27 1440 0.0 -1 1 {} H 0.0 {0.376885 0.342662 0.596043} H28 1441 0.0 -1 1 {} H 0.0 {0.40224 0.26517 0.387317} H29 1442 0.0 -1 1 {} H 0.0 {0.407719 0.252711 0.378216} H31 1443 0.0 -1 1 {} H 0.0 {0.300637 0.348999 0.554583} H32 1444 0.0 -1 1 {} H 0.0 {0.368428 0.386842 0.5446} H33 1445 0.0 -1 1 {} H 0.0 {0.341687 0.361169 0.574623} H34 1446 0.0 -1 7 {} N 0.0 {0.353349 0.393031 0.671077} N3 1447 0.0 -1 1 {} H 0.0 {0.356869 0.399309 0.664326} H16 1448 0.0 -1 1 {} H 0.0 {0.349465 0.399072 0.678268} H17 1449 0.0 -1 7 {} N 0.0 {0.397692 0.378391 0.649028} N6 1450 0.0 -1 1 {} H 0.0 {0.406036 0.381685 0.653316} H41 1451 0.0 -1 1 {} H 0.0 {0.399489 0.37755 0.639012} H42 1452 0.0 -1 14 {} Si 0.0 {0.53925 0.481558 0.77629} Si6 1453 0.0 -1 8 {} O 0.0 {0.553293 0.486453 0.781255} O6 1454 0.0 -1 14 {} Si 0.0 {0.565661 0.482687 0.790919} Si7 1455 0.0 -1 8 {} O 0.0 {0.577939 0.481256 0.780986} O7 1456 0.0 -1 14 {} Si 0.0 {0.583246 0.482355 0.766996} Si8 1457 0.0 -1 7 {} N 0.0 {0.591965 0.467712 0.75803} N2 1458 0.0 -1 14 {} Si 0.0 {0.608222 0.467619 0.755038} Si9 1459 0.0 -1 14 {} Si 0.0 {0.585844 0.452084 0.756289} Si10 1460 0.0 -1 6 {} C 0.0 {0.526069 0.472745 0.786184} C3 1461 0.0 -1 7 {} N 0.0 {0.570114 0.489559 0.806611} N 1462 0.0 -1 8 {} O 0.0 {0.559796 0.462534 0.79446} O8 1463 0.0 -1 8 {} O 0.0 {0.547669 0.472505 0.759549} O9 1464 0.0 -1 8 {} O 0.0 {0.537439 0.495865 0.769093} O10 1465 0.0 -1 1 {} H 0.0 {0.572617 0.486727 0.758116} H18 1466 0.0 -1 1 {} H 0.0 {0.57546 0.513403 0.741537} H19 1467 0.0 -1 1 {} H 0.0 {0.488415 0.394723 0.344452} H20 1468 0.0 -1 1 {} H 0.0 {0.616521 0.461715 0.762832} H22 1469 0.0 -1 1 {} H 0.0 {0.595312 0.443586 0.751649} H24 1470 0.0 -1 1 {} H 0.0 {0.576781 0.455019 0.742927} H25 1471 0.0 -1 1 {} H 0.0 {0.517827 0.471088 0.77968} H26 1472 0.0 -1 1 {} H 0.0 {0.523619 0.478801 0.794447} H27 1473 0.0 -1 1 {} H 0.0 {0.530138 0.463276 0.791014} H28 1474 0.0 -1 1 {} H 0.0 {0.567979 0.499596 0.806855} H29 1475 0.0 -1 1 {} H 0.0 {0.580124 0.488762 0.808442} H31 1476 0.0 -1 1 {} H 0.0 {0.560767 0.456672 0.786864} H32 1477 0.0 -1 1 {} H 0.0 {0.544797 0.478332 0.752184} H33 1478 0.0 -1 1 {} H 0.0 {0.567503 0.457573 0.801595} H34 1479 0.0 -1 7 {} N 0.0 {0.320204 0.260987 0.550566} N3 1480 0.0 -1 1 {} H 0.0 {0.329549 0.265119 0.550238} H16 1481 0.0 -1 1 {} H 0.0 {0.605264 0.463004 0.730009} H17 1482 0.0 -1 7 {} N 0.0 {0.574708 0.449809 0.771236} N6 1483 0.0 -1 1 {} H 0.0 {0.576154 0.459108 0.77447} H41 1484 0.0 -1 1 {} H 0.0 {0.565136 0.450542 0.767234} H42 1485 0.0 -1 14 {} Si 0.0 {0.331826 0.47457 0.601186} Si6 1486 0.0 -1 8 {} O 0.0 {0.345852 0.467864 0.5956} O6 1487 0.0 -1 14 {} Si 0.0 {0.354266 0.454582 0.593752} Si7 1488 0.0 -1 8 {} O 0.0 {0.352357 0.452846 0.57859} O7 1489 0.0 -1 14 {} Si 0.0 {0.344932 0.446719 0.566521} Si8 1490 0.0 -1 7 {} N 0.0 {0.345893 0.453672 0.548239} N2 1491 0.0 -1 14 {} Si 0.0 {0.337917 0.447326 0.535209} Si9 1492 0.0 -1 14 {} Si 0.0 {0.353851 0.465869 0.539785} Si10 1493 0.0 -1 6 {} C 0.0 {0.33063 0.49202 0.61078} C3 1494 0.0 -1 7 {} N 0.0 {0.374318 0.457161 0.600816} N 1495 0.0 -1 8 {} O 0.0 {0.344538 0.44379 0.599529} O8 1496 0.0 -1 8 {} O 0.0 {0.32621 0.462035 0.609076} O9 1497 0.0 -1 8 {} O 0.0 {0.325337 0.474621 0.585985} O10 1498 0.0 -1 1 {} H 0.0 {0.347187 0.431723 0.565821} H18 1499 0.0 -1 1 {} H 0.0 {0.328709 0.448078 0.568418} H19 1500 0.0 -1 1 {} H 0.0 {0.326843 0.440589 0.540987} H20 1501 0.0 -1 1 {} H 0.0 {0.331018 0.456947 0.522822} H22 1502 0.0 -1 1 {} H 0.0 {0.365278 0.46049 0.531431} H24 1503 0.0 -1 1 {} H 0.0 {0.362954 0.471564 0.554486} H25 1504 0.0 -1 1 {} H 0.0 {0.322402 0.491365 0.617169} H26 1505 0.0 -1 1 {} H 0.0 {0.329686 0.499627 0.603914} H27 1506 0.0 -1 1 {} H 0.0 {0.340061 0.494183 0.615569} H28 1507 0.0 -1 1 {} H 0.0 {0.375207 0.446401 0.602072} H29 1508 0.0 -1 1 {} H 0.0 {0.379869 0.458542 0.591841} H31 1509 0.0 -1 1 {} H 0.0 {0.337472 0.449278 0.604518} H32 1510 0.0 -1 1 {} H 0.0 {0.311393 0.453145 0.575993} H33 1511 0.0 -1 1 {} H 0.0 {0.316468 0.470902 0.585819} H34 1512 0.0 -1 7 {} N 0.0 {0.347218 0.432885 0.526947} N3 1513 0.0 -1 1 {} H 0.0 {0.344525 0.435045 0.5174} H16 1514 0.0 -1 1 {} H 0.0 {0.356805 0.435942 0.527469} H17 1515 0.0 -1 7 {} N 0.0 {0.343139 0.481387 0.536622} N6 1516 0.0 -1 1 {} H 0.0 {0.348684 0.486305 0.529888} H41 1517 0.0 -1 1 {} H 0.0 {0.335656 0.478017 0.530561} H42 1518 0.0 -1 14 {} Si 0.0 {0.431831 0.700299 0.63134} Si6 1519 0.0 -1 8 {} O 0.0 {0.440824 0.692206 0.641855} O6 1520 0.0 -1 14 {} Si 0.0 {0.446595 0.68117 0.651263} Si7 1521 0.0 -1 8 {} O 0.0 {0.527915 0.733699 0.578211} O7 1522 0.0 -1 14 {} Si 0.0 {0.521407 0.742481 0.589854} Si8 1523 0.0 -1 7 {} N 0.0 {0.49848 0.714942 0.612213} N2 1524 0.0 -1 14 {} Si 0.0 {0.514394 0.7115 0.614022} Si9 1525 0.0 -1 14 {} Si 0.0 {0.499938 0.726946 0.597085} Si10 1526 0.0 -1 6 {} C 0.0 {0.428288 0.715725 0.629869} C3 1527 0.0 -1 7 {} N 0.0 {0.376277 0.567674 0.204003} N 1528 0.0 -1 8 {} O 0.0 {0.434719 0.6714 0.65589} O8 1529 0.0 -1 8 {} O 0.0 {0.457544 0.671334 0.645371} O9 1530 0.0 -1 8 {} O 0.0 {0.426486 0.687527 0.623061} O10 1531 0.0 -1 1 {} H 0.0 {0.522724 0.74619 0.56396} H18 1532 0.0 -1 1 {} H 0.0 {0.499693 0.754852 0.598183} H19 1533 0.0 -1 1 {} H 0.0 {0.521863 0.721451 0.622794} H20 1534 0.0 -1 1 {} H 0.0 {0.513187 0.695834 0.621223} H22 1535 0.0 -1 1 {} H 0.0 {0.644078 0.420992 0.771044} H24 1536 0.0 -1 1 {} H 0.0 {0.510868 0.73498 0.593535} H25 1537 0.0 -1 1 {} H 0.0 {0.639574 0.669567 0.379577} H26 1538 0.0 -1 1 {} H 0.0 {0.41802 0.716606 0.626821} H27 1539 0.0 -1 1 {} H 0.0 {0.435712 0.721742 0.625891} H28 1540 0.0 -1 1 {} H 0.0 {0.367761 0.567053 0.209016} H29 1541 0.0 -1 1 {} H 0.0 {0.381209 0.558908 0.205827} H31 1542 0.0 -1 1 {} H 0.0 {0.455731 0.668486 0.63585} H32 1543 0.0 -1 1 {} H 0.0 {0.659608 0.617421 0.403816} H33 1544 0.0 -1 1 {} H 0.0 {0.42746 0.674141 0.650128} H34 1545 0.0 -1 7 {} N 0.0 {0.525333 0.703604 0.600638} N3 1546 0.0 -1 1 {} H 0.0 {0.532434 0.710385 0.598379} H16 1547 0.0 -1 1 {} H 0.0 {0.517759 0.704354 0.59321} H17 1548 0.0 -1 7 {} N 0.0 {0.484418 0.739415 0.59842} N6 1549 0.0 -1 1 {} H 0.0 {0.476889 0.732547 0.596864} H41 1550 0.0 -1 1 {} H 0.0 {0.485442 0.740081 0.608652} H42 1551 0.0 -1 14 {} Si 0.0 {0.49467 0.579171 0.733005} Si6 1552 0.0 -1 8 {} O 0.0 {0.487444 0.588756 0.721906} O6 1553 0.0 -1 14 {} Si 0.0 {0.482895 0.603537 0.718364} Si7 1554 0.0 -1 8 {} O 0.0 {0.474846 0.60205 0.704974} O7 1555 0.0 -1 14 {} Si 0.0 {0.477713 0.599645 0.689297} Si8 1556 0.0 -1 7 {} N 0.0 {0.496688 0.597072 0.688569} N2 1557 0.0 -1 14 {} Si 0.0 {0.503076 0.602994 0.7057} Si9 1558 0.0 -1 14 {} Si 0.0 {0.502701 0.582533 0.692707} Si10 1559 0.0 -1 6 {} C 0.0 {0.488078 0.57459 0.748813} C3 1560 0.0 -1 7 {} N 0.0 {0.479296 0.621857 0.726288} N 1561 0.0 -1 8 {} O 0.0 {0.505593 0.632063 0.702946} O8 1562 0.0 -1 8 {} O 0.0 {0.510872 0.590648 0.732482} O9 1563 0.0 -1 8 {} O 0.0 {0.501712 0.566408 0.719224} O10 1564 0.0 -1 1 {} H 0.0 {0.467542 0.588699 0.686599} H18 1565 0.0 -1 1 {} H 0.0 {0.472754 0.611636 0.683421} H19 1566 0.0 -1 1 {} H 0.0 {0.504869 0.621044 0.70394} H20 1567 0.0 -1 1 {} H 0.0 {0.507744 0.596856 0.721121} H22 1568 0.0 -1 1 {} H 0.0 {0.495826 0.575014 0.68237} H24 1569 0.0 -1 1 {} H 0.0 {0.501424 0.5735 0.707537} H25 1570 0.0 -1 1 {} H 0.0 {0.48726 0.558071 0.746411} H26 1571 0.0 -1 1 {} H 0.0 {0.477846 0.578488 0.747981} H27 1572 0.0 -1 1 {} H 0.0 {0.493042 0.579957 0.757026} H28 1573 0.0 -1 1 {} H 0.0 {0.487297 0.62839 0.725637} H29 1574 0.0 -1 1 {} H 0.0 {0.479485 0.617886 0.735828} H31 1575 0.0 -1 1 {} H 0.0 {0.503806 0.634302 0.693774} H32 1576 0.0 -1 1 {} H 0.0 {0.517918 0.584064 0.728888} H33 1577 0.0 -1 1 {} H 0.0 {0.511521 0.567073 0.721007} H34 1578 0.0 -1 7 {} N 0.0 {0.522997 0.607404 0.706161} N3 1579 0.0 -1 1 {} H 0.0 {0.52846 0.602805 0.713846} H16 1580 0.0 -1 1 {} H 0.0 {0.525622 0.601538 0.697919} H17 1581 0.0 -1 7 {} N 0.0 {0.519576 0.580398 0.682904} N6 1582 0.0 -1 1 {} H 0.0 {0.519444 0.586253 0.675142} H41 1583 0.0 -1 1 {} H 0.0 {0.517383 0.571157 0.679533} H42 1584 0.0 -1 14 {} Si 0.0 {0.513692 0.48399 0.38878} Si6 1585 0.0 -1 8 {} O 0.0 {0.53329 0.513418 0.393992} O6 1586 0.0 -1 14 {} Si 0.0 {0.542089 0.513774 0.381019} Si7 1587 0.0 -1 8 {} O 0.0 {0.545416 0.509881 0.336157} O7 1588 0.0 -1 14 {} Si 0.0 {0.550562 0.479393 0.342954} Si8 1589 0.0 -1 7 {} N 0.0 {0.626454 0.572561 0.391416} N2 1590 0.0 -1 14 {} Si 0.0 {0.540829 0.485588 0.317009} Si9 1591 0.0 -1 14 {} Si 0.0 {0.527419 0.493477 0.367844} Si10 1592 0.0 -1 6 {} C 0.0 {0.540252 0.476144 0.356923} C3 1593 0.0 -1 7 {} N 0.0 {0.541774 0.5306 0.372049} N 1594 0.0 -1 8 {} O 0.0 {0.556355 0.5062 0.383859} O8 1595 0.0 -1 8 {} O 0.0 {0.553063 0.451451 0.377851} O9 1596 0.0 -1 8 {} O 0.0 {0.577186 0.463436 0.473851} O10 1597 0.0 -1 1 {} H 0.0 {0.460307 0.538257 0.221104} H18 1598 0.0 -1 1 {} H 0.0 {0.572286 0.524846 0.285689} H19 1599 0.0 -1 1 {} H 0.0 {0.509626 0.350476 0.417277} H20 1600 0.0 -1 1 {} H 0.0 {0.490567 0.746075 0.56445} H22 1601 0.0 -1 1 {} H 0.0 {0.533863 0.503141 0.374011} H24 1602 0.0 -1 1 {} H 0.0 {0.503003 0.468706 0.380107} H25 1603 0.0 -1 1 {} H 0.0 {0.546475 0.471193 0.363752} H26 1604 0.0 -1 1 {} H 0.0 {0.545768 0.482436 0.328894} H27 1605 0.0 -1 1 {} H 0.0 {0.532985 0.469516 0.352986} H28 1606 0.0 -1 1 {} H 0.0 {0.541551 0.537549 0.379439} H29 1607 0.0 -1 1 {} H 0.0 {0.551962 0.530097 0.36957} H31 1608 0.0 -1 1 {} H 0.0 {0.562217 0.509676 0.377154} H32 1609 0.0 -1 1 {} H 0.0 {0.520675 0.488585 0.378176} H33 1610 0.0 -1 1 {} H 0.0 {0.582187 0.459588 0.481465} H34 1611 0.0 -1 7 {} N 0.0 {0.300311 0.424843 0.528135} N3 1612 0.0 -1 1 {} H 0.0 {0.301433 0.415794 0.533398} H16 1613 0.0 -1 1 {} H 0.0 {0.561656 0.485499 0.346008} H17 1614 0.0 -1 7 {} N 0.0 {0.564486 0.436117 0.382638} N6 1615 0.0 -1 1 {} H 0.0 {0.567332 0.431972 0.373601} H41 1616 0.0 -1 1 {} H 0.0 {0.557677 0.429924 0.386871} H42 1617 0.0 -1 14 {} Si 0.0 {0.286613 0.475292 0.478448} Si6 1618 0.0 -1 8 {} O 0.0 {0.29722 0.4864 0.478427} O6 1619 0.0 -1 14 {} Si 0.0 {0.25041 0.526428 0.439475} Si7 1620 0.0 -1 8 {} O 0.0 {0.26488 0.528504 0.434034} O7 1621 0.0 -1 14 {} Si 0.0 {0.275288 0.539303 0.430389} Si8 1622 0.0 -1 7 {} N 0.0 {0.272043 0.551174 0.419529} N2 1623 0.0 -1 14 {} Si 0.0 {0.257587 0.565377 0.420772} Si9 1624 0.0 -1 14 {} Si 0.0 {0.271467 0.55338 0.403992} Si10 1625 0.0 -1 6 {} C 0.0 {0.284503 0.464317 0.464915} C3 1626 0.0 -1 7 {} N 0.0 {0.322033 0.461693 0.448114} N 1627 0.0 -1 8 {} O 0.0 {0.328601 0.435131 0.426267} O8 1628 0.0 -1 8 {} O 0.0 {0.271104 0.488763 0.482585} O9 1629 0.0 -1 8 {} O 0.0 {0.288749 0.469994 0.493458} O10 1630 0.0 -1 1 {} H 0.0 {0.283096 0.544143 0.443117} H18 1631 0.0 -1 1 {} H 0.0 {0.287667 0.531707 0.418929} H19 1632 0.0 -1 1 {} H 0.0 {0.262109 0.581915 0.420308} H20 1633 0.0 -1 1 {} H 0.0 {0.245149 0.564825 0.409469} H22 1634 0.0 -1 1 {} H 0.0 {0.227651 0.49952 0.336319} H24 1635 0.0 -1 1 {} H 0.0 {0.268988 0.568567 0.399469} H25 1636 0.0 -1 1 {} H 0.0 {0.29899 0.461674 0.459047} H26 1637 0.0 -1 1 {} H 0.0 {0.279104 0.470071 0.457058} H27 1638 0.0 -1 1 {} H 0.0 {0.280901 0.455085 0.468602} H28 1639 0.0 -1 1 {} H 0.0 {0.294617 0.495661 0.480886} H29 1640 0.0 -1 1 {} H 0.0 {0.325644 0.461965 0.438737} H31 1641 0.0 -1 1 {} H 0.0 {0.25072 0.512023 0.443426} H32 1642 0.0 -1 1 {} H 0.0 {0.275583 0.497428 0.484505} H33 1643 0.0 -1 1 {} H 0.0 {0.280624 0.468786 0.498566} H34 1644 0.0 -1 7 {} N 0.0 {0.245729 0.560799 0.437865} N3 1645 0.0 -1 1 {} H 0.0 {0.246221 0.550251 0.439773} H16 1646 0.0 -1 1 {} H 0.0 {0.238025 0.56384 0.443234} H17 1647 0.0 -1 7 {} N 0.0 {0.258404 0.542095 0.394304} N6 1648 0.0 -1 1 {} H 0.0 {0.26042 0.545814 0.384935} H41 1649 0.0 -1 1 {} H 0.0 {0.249505 0.546126 0.3984} H42 1650 0.0 -1 14 {} Si 0.0 {0.500046 0.63172 0.455791} Si6 1651 0.0 -1 8 {} O 0.0 {0.505857 0.68719 0.473957} O6 1652 0.0 -1 14 {} Si 0.0 {0.491515 0.678054 0.486275} Si7 1653 0.0 -1 8 {} O 0.0 {0.503092 0.669015 0.492894} O7 1654 0.0 -1 14 {} Si 0.0 {0.512726 0.656723 0.489908} Si8 1655 0.0 -1 7 {} N 0.0 {0.518792 0.642813 0.501748} N2 1656 0.0 -1 14 {} Si 0.0 {0.51995 0.653743 0.513824} Si9 1657 0.0 -1 14 {} Si 0.0 {0.515735 0.626839 0.504114} Si10 1658 0.0 -1 6 {} C 0.0 {0.478266 0.619861 0.481526} C3 1659 0.0 -1 7 {} N 0.0 {0.476671 0.682487 0.498264} N 1660 0.0 -1 8 {} O 0.0 {0.486123 0.667388 0.475257} O8 1661 0.0 -1 8 {} O 0.0 {0.495986 0.640903 0.443579} O9 1662 0.0 -1 8 {} O 0.0 {0.495205 0.639545 0.469751} O10 1663 0.0 -1 1 {} H 0.0 {0.504292 0.647612 0.47936} H18 1664 0.0 -1 1 {} H 0.0 {0.508204 0.679209 0.468319} H19 1665 0.0 -1 1 {} H 0.0 {0.53416 0.670284 0.468729} H20 1666 0.0 -1 1 {} H 0.0 {0.532306 0.659294 0.515105} H22 1667 0.0 -1 1 {} H 0.0 {0.50116 0.623658 0.510682} H24 1668 0.0 -1 1 {} H 0.0 {0.525112 0.61809 0.512753} H25 1669 0.0 -1 1 {} H 0.0 {0.477135 0.609397 0.480927} H26 1670 0.0 -1 1 {} H 0.0 {0.48798 0.622127 0.484256} H27 1671 0.0 -1 1 {} H 0.0 {0.476602 0.624282 0.472246} H28 1672 0.0 -1 1 {} H 0.0 {0.475612 0.673079 0.502062} H29 1673 0.0 -1 1 {} H 0.0 {0.481475 0.687392 0.50598} H31 1674 0.0 -1 1 {} H 0.0 {0.481132 0.672682 0.467667} H32 1675 0.0 -1 1 {} H 0.0 {0.491271 0.635113 0.436749} H33 1676 0.0 -1 1 {} H 0.0 {0.490766 0.648333 0.466108} H34 1677 0.0 -1 7 {} N 0.0 {0.508752 0.64821 0.528249} N3 1678 0.0 -1 1 {} H 0.0 {0.498781 0.648629 0.527895} H16 1679 0.0 -1 1 {} H 0.0 {0.512357 0.639568 0.531864} H17 1680 0.0 -1 7 {} N 0.0 {0.513853 0.619879 0.48569} N6 1681 0.0 -1 1 {} H 0.0 {0.52417 0.619421 0.483766} H41 1682 0.0 -1 1 {} H 0.0 {0.50993 0.629107 0.483007} H42 1683 0.0 -1 14 {} Si 0.0 {0.437735 0.630914 0.403279} Si6 1684 0.0 -1 8 {} O 0.0 {0.433549 0.618091 0.394233} O6 1685 0.0 -1 14 {} Si 0.0 {0.438465 0.607045 0.383323} Si7 1686 0.0 -1 8 {} O 0.0 {0.433709 0.615799 0.371058} O7 1687 0.0 -1 14 {} Si 0.0 {0.422619 0.626257 0.366457} Si8 1688 0.0 -1 7 {} N 0.0 {0.423663 0.632986 0.347616} N2 1689 0.0 -1 14 {} Si 0.0 {0.43067 0.620259 0.340143} Si9 1690 0.0 -1 14 {} Si 0.0 {0.432729 0.646556 0.340156} Si10 1691 0.0 -1 6 {} C 0.0 {0.43681 0.647327 0.396733} C3 1692 0.0 -1 7 {} N 0.0 {0.457938 0.602262 0.38169} N 1693 0.0 -1 8 {} O 0.0 {0.426305 0.596346 0.384146} O8 1694 0.0 -1 8 {} O 0.0 {0.455501 0.620801 0.409524} O9 1695 0.0 -1 8 {} O 0.0 {0.427467 0.625977 0.413932} O10 1696 0.0 -1 1 {} H 0.0 {0.410414 0.616445 0.365846} H18 1697 0.0 -1 1 {} H 0.0 {0.422076 0.636591 0.375667} H19 1698 0.0 -1 1 {} H 0.0 {0.423754 0.606536 0.34706} H20 1699 0.0 -1 1 {} H 0.0 {0.588257 0.335802 0.635896} H22 1700 0.0 -1 1 {} H 0.0 {0.430837 0.645455 0.325599} H24 1701 0.0 -1 1 {} H 0.0 {0.446151 0.648043 0.342703} H25 1702 0.0 -1 1 {} H 0.0 {0.435858 0.654501 0.40473} H26 1703 0.0 -1 1 {} H 0.0 {0.427097 0.647843 0.392208} H27 1704 0.0 -1 1 {} H 0.0 {0.442331 0.648206 0.380263} H28 1705 0.0 -1 1 {} H 0.0 {0.457342 0.592366 0.380439} H29 1706 0.0 -1 1 {} H 0.0 {0.45915 0.605846 0.372009} H31 1707 0.0 -1 1 {} H 0.0 {0.422427 0.596945 0.393849} H32 1708 0.0 -1 1 {} H 0.0 {0.459435 0.616759 0.401356} H33 1709 0.0 -1 1 {} H 0.0 {0.430828 0.620508 0.421169} H34 1710 0.0 -1 7 {} N 0.0 {0.424411 0.618564 0.323023} N3 1711 0.0 -1 1 {} H 0.0 {0.679169 0.297813 0.623748} H16 1712 0.0 -1 1 {} H 0.0 {0.431489 0.621936 0.316939} H17 1713 0.0 -1 7 {} N 0.0 {0.423237 0.662273 0.348103} N6 1714 0.0 -1 1 {} H 0.0 {0.416081 0.65637 0.352073} H41 1715 0.0 -1 1 {} H 0.0 {0.43138 0.663397 0.353819} H42 1716 0.0 -1 14 {} Si 0.0 {0.587803 0.565373 0.573348} Si6 1717 0.0 -1 8 {} O 0.0 {0.58984 0.569953 0.558626} O6 1718 0.0 -1 14 {} Si 0.0 {0.589934 0.565482 0.543162} Si7 1719 0.0 -1 8 {} O 0.0 {0.575956 0.557738 0.542158} O7 1720 0.0 -1 14 {} Si 0.0 {0.560839 0.556039 0.546687} Si8 1721 0.0 -1 7 {} N 0.0 {0.550112 0.543364 0.535965} N2 1722 0.0 -1 14 {} Si 0.0 {0.542698 0.542252 0.521527} Si9 1723 0.0 -1 14 {} Si 0.0 {0.55766 0.530361 0.542838} Si10 1724 0.0 -1 6 {} C 0.0 {0.571775 0.567936 0.583313} C3 1725 0.0 -1 7 {} N 0.0 {0.593899 0.580637 0.529641} N 1726 0.0 -1 8 {} O 0.0 {0.600332 0.553288 0.543664} O8 1727 0.0 -1 8 {} O 0.0 {0.596355 0.551328 0.572953} O9 1728 0.0 -1 8 {} O 0.0 {0.586249 0.528851 0.546453} O10 1729 0.0 -1 1 {} H 0.0 {0.560847 0.556396 0.561679} H18 1730 0.0 -1 1 {} H 0.0 {0.553071 0.570906 0.542777} H19 1731 0.0 -1 1 {} H 0.0 {0.55246 0.538413 0.510562} H20 1732 0.0 -1 1 {} H 0.0 {0.530021 0.532029 0.522742} H22 1733 0.0 -1 1 {} H 0.0 {0.574526 0.531549 0.545387} H24 1734 0.0 -1 1 {} H 0.0 {0.558259 0.513526 0.534987} H25 1735 0.0 -1 1 {} H 0.0 {0.563701 0.568537 0.576629} H26 1736 0.0 -1 1 {} H 0.0 {0.571666 0.576547 0.589278} H27 1737 0.0 -1 1 {} H 0.0 {0.570096 0.558411 0.58809} H28 1738 0.0 -1 1 {} H 0.0 {0.595252 0.574661 0.521732} H29 1739 0.0 -1 1 {} H 0.0 {0.602229 0.584342 0.534255} H31 1740 0.0 -1 1 {} H 0.0 {0.605841 0.554545 0.535931} H32 1741 0.0 -1 1 {} H 0.0 {0.596363 0.548114 0.563516} H33 1742 0.0 -1 1 {} H 0.0 {0.589553 0.538047 0.549338} H34 1743 0.0 -1 7 {} N 0.0 {0.541011 0.559337 0.512616} N3 1744 0.0 -1 1 {} H 0.0 {0.534277 0.565378 0.516035} H16 1745 0.0 -1 1 {} H 0.0 {0.550238 0.563061 0.514169} H17 1746 0.0 -1 7 {} N 0.0 {0.550868 0.527494 0.560139} N6 1747 0.0 -1 1 {} H 0.0 {0.540948 0.527643 0.558303} H41 1748 0.0 -1 1 {} H 0.0 {0.553682 0.517964 0.562423} H42 1749 0.0 -1 14 {} Si 0.0 {0.399882 0.598745 0.350536} Si6 1750 0.0 -1 8 {} O 0.0 {0.398181 0.583883 0.354929} O6 1751 0.0 -1 14 {} Si 0.0 {0.390814 0.571962 0.362497} Si7 1752 0.0 -1 8 {} O 0.0 {0.402586 0.566138 0.371067} O7 1753 0.0 -1 14 {} Si 0.0 {0.414782 0.556016 0.370863} Si8 1754 0.0 -1 7 {} N 0.0 {0.433266 0.561638 0.375883} N2 1755 0.0 -1 14 {} Si 0.0 {0.447719 0.555889 0.370225} Si9 1756 0.0 -1 14 {} Si 0.0 {0.436202 0.566664 0.390981} Si10 1757 0.0 -1 6 {} C 0.0 {0.394333 0.607317 0.334893} C3 1758 0.0 -1 7 {} N 0.0 {0.37696 0.574246 0.3727} N 1759 0.0 -1 8 {} O 0.0 {0.385986 0.558245 0.346483} O8 1760 0.0 -1 8 {} O 0.0 {0.420142 0.595542 0.352967} O9 1761 0.0 -1 8 {} O 0.0 {0.397975 0.606594 0.364755} O10 1762 0.0 -1 1 {} H 0.0 {0.410441 0.545067 0.377537} H18 1763 0.0 -1 1 {} H 0.0 {0.417201 0.551826 0.357161} H19 1764 0.0 -1 1 {} H 0.0 {0.457287 0.568763 0.363212} H20 1765 0.0 -1 1 {} H 0.0 {0.456635 0.553301 0.381082} H22 1766 0.0 -1 1 {} H 0.0 {0.432182 0.581872 0.386435} H24 1767 0.0 -1 1 {} H 0.0 {0.450484 0.567059 0.397011} H25 1768 0.0 -1 1 {} H 0.0 {0.384285 0.611169 0.336901} H26 1769 0.0 -1 1 {} H 0.0 {0.394374 0.600608 0.326421} H27 1770 0.0 -1 1 {} H 0.0 {0.400549 0.615559 0.333139} H28 1771 0.0 -1 1 {} H 0.0 {0.373247 0.567568 0.380106} H29 1772 0.0 -1 1 {} H 0.0 {0.368702 0.574459 0.366762} H31 1773 0.0 -1 1 {} H 0.0 {0.389725 0.549686 0.3478} H32 1774 0.0 -1 1 {} H 0.0 {0.421044 0.596171 0.362709} H33 1775 0.0 -1 1 {} H 0.0 {0.397616 0.599939 0.372608} H34 1776 0.0 -1 7 {} N 0.0 {0.448528 0.538059 0.361593} N3 1777 0.0 -1 1 {} H 0.0 {0.446894 0.531968 0.369644} H16 1778 0.0 -1 1 {} H 0.0 {0.439449 0.538353 0.356709} H17 1779 0.0 -1 7 {} N 0.0 {0.422431 0.557756 0.403356} N6 1780 0.0 -1 1 {} H 0.0 {0.424923 0.548772 0.398656} H41 1781 0.0 -1 1 {} H 0.0 {0.415315 0.561458 0.397317} H42 1782 0.0 -1 14 {} Si 0.0 {0.407387 0.285252 0.521206} Si6 1783 0.0 -1 8 {} O 0.0 {0.412453 0.275778 0.532682} O6 1784 0.0 -1 14 {} Si 0.0 {0.407862 0.263474 0.542272} Si7 1785 0.0 -1 8 {} O 0.0 {0.413628 0.269928 0.555611} O7 1786 0.0 -1 14 {} Si 0.0 {0.422679 0.278656 0.565161} Si8 1787 0.0 -1 7 {} N 0.0 {0.412078 0.277851 0.581377} N2 1788 0.0 -1 14 {} Si 0.0 {0.449116 0.335734 0.631156} Si9 1789 0.0 -1 14 {} Si 0.0 {0.39881 0.271342 0.589211} Si10 1790 0.0 -1 6 {} C 0.0 {0.403804 0.303655 0.525054} C3 1791 0.0 -1 7 {} N 0.0 {0.389788 0.257911 0.542222} N 1792 0.0 -1 8 {} O 0.0 {0.419957 0.251053 0.538229} O8 1793 0.0 -1 8 {} O 0.0 {0.396012 0.274853 0.515674} O9 1794 0.0 -1 8 {} O 0.0 {0.422355 0.280498 0.509112} O10 1795 0.0 -1 1 {} H 0.0 {0.435575 0.269138 0.564792} H18 1796 0.0 -1 1 {} H 0.0 {0.423583 0.291091 0.557284} H19 1797 0.0 -1 1 {} H 0.0 {0.453045 0.249862 0.542091} H20 1798 0.0 -1 1 {} H 0.0 {0.459081 0.348117 0.634163} H22 1799 0.0 -1 1 {} H 0.0 {0.392779 0.280502 0.597152} H24 1800 0.0 -1 1 {} H 0.0 {0.405115 0.262499 0.59799} H25 1801 0.0 -1 1 {} H 0.0 {0.399745 0.304192 0.534524} H26 1802 0.0 -1 1 {} H 0.0 {0.395258 0.305693 0.518693} H27 1803 0.0 -1 1 {} H 0.0 {0.411639 0.310103 0.523417} H28 1804 0.0 -1 1 {} H 0.0 {0.389207 0.256422 0.552215} H29 1805 0.0 -1 1 {} H 0.0 {0.38396 0.266113 0.54124} H31 1806 0.0 -1 1 {} H 0.0 {0.428845 0.255339 0.538253} H32 1807 0.0 -1 1 {} H 0.0 {0.393819 0.268289 0.521661} H33 1808 0.0 -1 1 {} H 0.0 {0.420656 0.271207 0.506585} H34 1809 0.0 -1 7 {} N 0.0 {0.455027 0.208236 0.356376} N3 1810 0.0 -1 1 {} H 0.0 {0.45302 0.218012 0.359756} H16 1811 0.0 -1 1 {} H 0.0 {0.464738 0.206215 0.358833} H17 1812 0.0 -1 7 {} N 0.0 {0.387761 0.261117 0.576497} N6 1813 0.0 -1 1 {} H 0.0 {0.377878 0.262312 0.57809} H41 1814 0.0 -1 1 {} H 0.0 {0.390185 0.266512 0.568049} H42 1815 0.0 -1 14 {} Si 0.0 {0.638766 0.450698 0.449878} Si6 1816 0.0 -1 8 {} O 0.0 {0.631543 0.452697 0.463652} O6 1817 0.0 -1 14 {} Si 0.0 {0.62804 0.449295 0.478596} Si7 1818 0.0 -1 8 {} O 0.0 {0.63214 0.463655 0.484522} O7 1819 0.0 -1 14 {} Si 0.0 {0.645278 0.473033 0.484084} Si8 1820 0.0 -1 7 {} N 0.0 {0.657877 0.474197 0.469006} N2 1821 0.0 -1 14 {} Si 0.0 {0.661866 0.458035 0.464613} Si9 1822 0.0 -1 14 {} Si 0.0 {0.663019 0.486292 0.459873} Si10 1823 0.0 -1 6 {} C 0.0 {0.635916 0.434719 0.439129} C3 1824 0.0 -1 7 {} N 0.0 {0.610317 0.443297 0.483671} N 1825 0.0 -1 8 {} O 0.0 {0.643423 0.439507 0.482811} O8 1826 0.0 -1 8 {} O 0.0 {0.605455 0.424076 0.460093} O9 1827 0.0 -1 8 {} O 0.0 {0.637555 0.470244 0.445668} O10 1828 0.0 -1 1 {} H 0.0 {0.640893 0.485636 0.489359} H18 1829 0.0 -1 1 {} H 0.0 {0.653341 0.46822 0.496384} H19 1830 0.0 -1 1 {} H 0.0 {0.676942 0.455479 0.473402} H20 1831 0.0 -1 1 {} H 0.0 {0.651903 0.449557 0.474544} H22 1832 0.0 -1 1 {} H 0.0 {0.667724 0.484845 0.444697} H24 1833 0.0 -1 1 {} H 0.0 {0.675214 0.492446 0.46996} H25 1834 0.0 -1 1 {} H 0.0 {0.644801 0.431271 0.434735} H26 1835 0.0 -1 1 {} H 0.0 {0.609139 0.428546 0.46861} H27 1836 0.0 -1 1 {} H 0.0 {0.631492 0.428308 0.445638} H28 1837 0.0 -1 1 {} H 0.0 {0.606884 0.452724 0.482012} H29 1838 0.0 -1 1 {} H 0.0 {0.61167 0.442242 0.49369} H31 1839 0.0 -1 1 {} H 0.0 {0.643748 0.432594 0.475706} H32 1840 0.0 -1 1 {} H 0.0 {0.597268 0.420449 0.462942} H33 1841 0.0 -1 1 {} H 0.0 {0.641746 0.475119 0.452939} H34 1842 0.0 -1 7 {} N 0.0 {0.659242 0.454142 0.445135} N3 1843 0.0 -1 1 {} H 0.0 {0.663309 0.444311 0.446365} H16 1844 0.0 -1 1 {} H 0.0 {0.657802 0.463609 0.441776} H17 1845 0.0 -1 7 {} N 0.0 {0.646314 0.498579 0.458036} N6 1846 0.0 -1 1 {} H 0.0 {0.647705 0.500473 0.447592} H41 1847 0.0 -1 1 {} H 0.0 {0.649504 0.507758 0.462129} H42 1848 0.0 -1 14 {} Si 0.0 {0.533623 0.621622 0.61393} Si6 1849 0.0 -1 8 {} O 0.0 {0.19614 0.519796 0.505175} O6 1850 0.0 -1 14 {} Si 0.0 {0.201922 0.532006 0.497655} Si7 1851 0.0 -1 8 {} O 0.0 {0.214996 0.535467 0.505211} O7 1852 0.0 -1 14 {} Si 0.0 {0.219708 0.532384 0.519896} Si8 1853 0.0 -1 7 {} N 0.0 {0.233983 0.525355 0.527263} N2 1854 0.0 -1 14 {} Si 0.0 {0.246315 0.529809 0.541695} Si9 1855 0.0 -1 14 {} Si 0.0 {0.242888 0.538753 0.514937} Si10 1856 0.0 -1 6 {} C 0.0 {0.531521 0.634406 0.60051} C3 1857 0.0 -1 7 {} N 0.0 {0.205098 0.528775 0.479541} N 1858 0.0 -1 8 {} O 0.0 {0.191721 0.548193 0.503412} O8 1859 0.0 -1 8 {} O 0.0 {0.519969 0.616036 0.62055} O9 1860 0.0 -1 8 {} O 0.0 {0.541625 0.624227 0.627333} O10 1861 0.0 -1 1 {} H 0.0 {0.217119 0.544632 0.528192} H18 1862 0.0 -1 1 {} H 0.0 {0.186813 0.520012 0.504534} H19 1863 0.0 -1 1 {} H 0.0 {0.259645 0.522698 0.53448} H20 1864 0.0 -1 1 {} H 0.0 {0.261011 0.539787 0.544049} H22 1865 0.0 -1 1 {} H 0.0 {0.232465 0.545057 0.50523} H24 1866 0.0 -1 1 {} H 0.0 {0.251606 0.52933 0.50371} H25 1867 0.0 -1 1 {} H 0.0 {0.536665 0.642674 0.604921} H26 1868 0.0 -1 1 {} H 0.0 {0.520747 0.634335 0.600746} H27 1869 0.0 -1 1 {} H 0.0 {0.536605 0.632399 0.591385} H28 1870 0.0 -1 1 {} H 0.0 {0.214135 0.533044 0.478842} H29 1871 0.0 -1 1 {} H 0.0 {0.19935 0.53549 0.475063} H31 1872 0.0 -1 1 {} H 0.0 {0.510847 0.671859 0.599933} H32 1873 0.0 -1 1 {} H 0.0 {0.513672 0.623739 0.622721} H33 1874 0.0 -1 1 {} H 0.0 {0.539813 0.633795 0.630839} H34 1875 0.0 -1 7 {} N 0.0 {0.243647 0.514656 0.554616} N3 1876 0.0 -1 1 {} H 0.0 {0.248698 0.507003 0.55114} H16 1877 0.0 -1 1 {} H 0.0 {0.234374 0.511865 0.55112} H17 1878 0.0 -1 7 {} N 0.0 {0.250333 0.553399 0.520458} N6 1879 0.0 -1 1 {} H 0.0 {0.251603 0.559732 0.512694} H41 1880 0.0 -1 1 {} H 0.0 {0.244604 0.558029 0.527004} H42 1881 0.0 -1 14 {} Si 0.0 {0.563449 0.52228 0.487203} Si6 1882 0.0 -1 8 {} O 0.0 {0.573187 0.510575 0.492573} O6 1883 0.0 -1 14 {} Si 0.0 {0.582104 0.502945 0.503435} Si7 1884 0.0 -1 8 {} O 0.0 {0.586383 0.516136 0.511567} O7 1885 0.0 -1 14 {} Si 0.0 {0.596902 0.523528 0.520403} Si8 1886 0.0 -1 7 {} N 0.0 {0.614972 0.530748 0.514811} N2 1887 0.0 -1 14 {} Si 0.0 {0.63102 0.53155 0.517372} Si9 1888 0.0 -1 14 {} Si 0.0 {0.610096 0.531594 0.499419} Si10 1889 0.0 -1 6 {} C 0.0 {0.537842 0.523748 0.491003} C3 1890 0.0 -1 7 {} N 0.0 {0.578304 0.487857 0.511665} N 1891 0.0 -1 8 {} O 0.0 {0.600287 0.502035 0.494377} O8 1892 0.0 -1 8 {} O 0.0 {0.545781 0.52062 0.475745} O9 1893 0.0 -1 8 {} O 0.0 {0.564054 0.53361 0.50001} O10 1894 0.0 -1 1 {} H 0.0 {0.589331 0.527652 0.53497} H18 1895 0.0 -1 1 {} H 0.0 {0.604335 0.51267 0.526072} H19 1896 0.0 -1 1 {} H 0.0 {0.633015 0.537118 0.533543} H20 1897 0.0 -1 1 {} H 0.0 {0.638342 0.518259 0.514388} H22 1898 0.0 -1 1 {} H 0.0 {0.594902 0.529029 0.496815} H24 1899 0.0 -1 1 {} H 0.0 {0.61332 0.519176 0.492321} H25 1900 0.0 -1 1 {} H 0.0 {0.5308 0.530924 0.488972} H26 1901 0.0 -1 1 {} H 0.0 {0.543928 0.527385 0.498567} H27 1902 0.0 -1 1 {} H 0.0 {0.534163 0.514412 0.494096} H28 1903 0.0 -1 1 {} H 0.0 {0.568741 0.484649 0.507374} H29 1904 0.0 -1 1 {} H 0.0 {0.5753 0.491065 0.520482} H31 1905 0.0 -1 1 {} H 0.0 {0.601223 0.492294 0.492354} H32 1906 0.0 -1 1 {} H 0.0 {0.545604 0.529526 0.472128} H33 1907 0.0 -1 1 {} H 0.0 {0.570739 0.52957 0.507138} H34 1908 0.0 -1 7 {} N 0.0 {0.643192 0.54388 0.50951} N3 1909 0.0 -1 1 {} H 0.0 {0.63999 0.552303 0.514336} H16 1910 0.0 -1 1 {} H 0.0 {0.651424 0.541531 0.514618} H17 1911 0.0 -1 7 {} N 0.0 {0.613052 0.548941 0.491963} N6 1912 0.0 -1 1 {} H 0.0 {0.622701 0.549868 0.495207} H41 1913 0.0 -1 1 {} H 0.0 {0.608081 0.553957 0.49944} H42 1914 0.0 -1 14 {} Si 0.0 {0.288866 0.571475 0.341798} Si6 1915 0.0 -1 8 {} O 0.0 {0.295458 0.565328 0.328539} O6 1916 0.0 -1 14 {} Si 0.0 {0.27985 0.547497 0.340548} Si7 1917 0.0 -1 8 {} O 0.0 {0.363141 0.535537 0.333532} O7 1918 0.0 -1 14 {} Si 0.0 {0.264855 0.505474 0.359269} Si8 1919 0.0 -1 7 {} N 0.0 {0.380995 0.55148 0.295205} N2 1920 0.0 -1 14 {} Si 0.0 {0.368484 0.559206 0.287673} Si9 1921 0.0 -1 14 {} Si 0.0 {0.659445 0.561546 0.35541} Si10 1922 0.0 -1 6 {} C 0.0 {0.273723 0.595278 0.359302} C3 1923 0.0 -1 7 {} N 0.0 {0.262558 0.525207 0.365958} N 1924 0.0 -1 8 {} O 0.0 {0.62099 0.625865 0.432765} O8 1925 0.0 -1 8 {} O 0.0 {0.283709 0.590435 0.346215} O9 1926 0.0 -1 8 {} O 0.0 {0.647241 0.63858 0.465705} O10 1927 0.0 -1 1 {} H 0.0 {0.339063 0.473565 0.572252} H18 1928 0.0 -1 1 {} H 0.0 {0.706428 0.525323 0.382856} H19 1929 0.0 -1 1 {} H 0.0 {0.388556 0.549806 0.288351} H20 1930 0.0 -1 1 {} H 0.0 {0.35498 0.54958 0.293112} H22 1931 0.0 -1 1 {} H 0.0 {0.350525 0.472621 0.236182} H24 1932 0.0 -1 1 {} H 0.0 {0.35609 0.496508 0.258008} H25 1933 0.0 -1 1 {} H 0.0 {0.273354 0.606132 0.359961} H26 1934 0.0 -1 1 {} H 0.0 {0.290083 0.554521 0.327661} H27 1935 0.0 -1 1 {} H 0.0 {0.263946 0.591026 0.35811} H28 1936 0.0 -1 1 {} H 0.0 {0.263172 0.523778 0.376089} H29 1937 0.0 -1 1 {} H 0.0 {0.25232 0.526397 0.363472} H31 1938 0.0 -1 1 {} H 0.0 {0.650645 0.638121 0.456099} H32 1939 0.0 -1 1 {} H 0.0 {0.501626 0.655942 0.36584} H33 1940 0.0 -1 1 {} H 0.0 {0.642687 0.629606 0.465652} H34 1941 0.0 -1 7 {} N 0.0 {0.378684 0.539505 0.304926} N3 1942 0.0 -1 1 {} H 0.0 {0.370511 0.54144 0.311062} H16 1943 0.0 -1 1 {} H 0.0 {0.386064 0.537748 0.311671} H17 1944 0.0 -1 7 {} N 0.0 {0.329536 0.420194 0.625438} N6 1945 0.0 -1 1 {} H 0.0 {0.321488 0.414011 0.626088} H41 1946 0.0 -1 1 {} H 0.0 {0.443421 0.19291 0.47344} H42 1947 0.0 -1 14 {} Si 0.0 {0.482065 0.396305 0.534439} Si6 1948 0.0 -1 8 {} O 0.0 {0.490892 0.385726 0.527633} O6 1949 0.0 -1 14 {} Si 0.0 {0.502539 0.374886 0.529084} Si7 1950 0.0 -1 8 {} O 0.0 {0.516483 0.385831 0.539483} O7 1951 0.0 -1 14 {} Si 0.0 {0.502846 0.421312 0.541725} Si8 1952 0.0 -1 7 {} N 0.0 {0.506077 0.413284 0.528291} N2 1953 0.0 -1 14 {} Si 0.0 {0.539978 0.438182 0.550585} Si9 1954 0.0 -1 14 {} Si 0.0 {0.516076 0.415919 0.516614} Si10 1955 0.0 -1 6 {} C 0.0 {0.484931 0.408123 0.546874} C3 1956 0.0 -1 7 {} N 0.0 {0.510726 0.367653 0.516349} N 1957 0.0 -1 8 {} O 0.0 {0.442991 0.396906 0.509833} O8 1958 0.0 -1 8 {} O 0.0 {0.497299 0.365027 0.540033} O9 1959 0.0 -1 8 {} O 0.0 {0.470702 0.357189 0.63682} O10 1960 0.0 -1 1 {} H 0.0 {0.515143 0.425787 0.570987} H18 1961 0.0 -1 1 {} H 0.0 {0.529494 0.447791 0.543784} H19 1962 0.0 -1 1 {} H 0.0 {0.552352 0.420617 0.590521} H20 1963 0.0 -1 1 {} H 0.0 {0.648213 0.467564 0.650783} H22 1964 0.0 -1 1 {} H 0.0 {0.525117 0.42881 0.517976} H24 1965 0.0 -1 1 {} H 0.0 {0.509581 0.416102 0.504099} H25 1966 0.0 -1 1 {} H 0.0 {0.476444 0.414187 0.547195} H26 1967 0.0 -1 1 {} H 0.0 {0.512469 0.420734 0.550467} H27 1968 0.0 -1 1 {} H 0.0 {0.485488 0.403535 0.556622} H28 1969 0.0 -1 1 {} H 0.0 {0.519157 0.372068 0.513487} H29 1970 0.0 -1 1 {} H 0.0 {0.505068 0.367521 0.507642} H31 1971 0.0 -1 1 {} H 0.0 {0.433179 0.397115 0.511164} H32 1972 0.0 -1 1 {} H 0.0 {0.493451 0.35757 0.53559} H33 1973 0.0 -1 1 {} H 0.0 {0.465168 0.365403 0.637287} H34 1974 0.0 -1 7 {} N 0.0 {0.550471 0.430118 0.538013} N3 1975 0.0 -1 1 {} H 0.0 {0.55861 0.435912 0.536104} H16 1976 0.0 -1 1 {} H 0.0 {0.546 0.427505 0.529455} H17 1977 0.0 -1 7 {} N 0.0 {0.527635 0.400404 0.516725} N6 1978 0.0 -1 1 {} H 0.0 {0.522328 0.39432 0.509977} H41 1979 0.0 -1 1 {} H 0.0 {0.535834 0.404709 0.511683} H42 1980 0.0 -1 14 {} Si 0.0 {0.720838 0.447619 0.422835} Si6 1981 0.0 -1 8 {} O 0.0 {0.711413 0.457721 0.430225} O6 1982 0.0 -1 14 {} Si 0.0 {0.743736 0.45297 0.449297} Si7 1983 0.0 -1 8 {} O 0.0 {0.758178 0.459326 0.451144} O7 1984 0.0 -1 14 {} Si 0.0 {0.767294 0.471498 0.456298} Si8 1985 0.0 -1 7 {} N 0.0 {0.780765 0.476749 0.449251} N2 1986 0.0 -1 14 {} Si 0.0 {0.78763 0.475461 0.435115} Si9 1987 0.0 -1 14 {} Si 0.0 {0.428812 0.32416 0.318537} Si10 1988 0.0 -1 6 {} C 0.0 {0.450496 0.468152 0.803146} C3 1989 0.0 -1 7 {} N 0.0 {0.737624 0.442712 0.432815} N 1990 0.0 -1 8 {} O 0.0 {0.743865 0.447737 0.463824} O8 1991 0.0 -1 8 {} O 0.0 {0.478202 0.475013 0.79695} O9 1992 0.0 -1 8 {} O 0.0 {0.72715 0.453873 0.40998} O10 1993 0.0 -1 1 {} H 0.0 {0.415651 0.473731 0.450973} H18 1994 0.0 -1 1 {} H 0.0 {0.764782 0.468777 0.47373} H19 1995 0.0 -1 1 {} H 0.0 {0.784389 0.463245 0.428059} H20 1996 0.0 -1 1 {} H 0.0 {0.780073 0.488713 0.426358} H22 1997 0.0 -1 1 {} H 0.0 {0.412555 0.343435 0.25687} H24 1998 0.0 -1 1 {} H 0.0 {0.435857 0.328257 0.307438} H25 1999 0.0 -1 1 {} H 0.0 {0.387897 0.244065 0.47012} H26 2000 0.0 -1 1 {} H 0.0 {0.424165 0.471457 0.707783} H27 2001 0.0 -1 1 {} H 0.0 {0.442499 0.468811 0.79567} H28 2002 0.0 -1 1 {} H 0.0 {0.744753 0.444438 0.42629} H29 2003 0.0 -1 1 {} H 0.0 {0.736905 0.433439 0.436051} H31 2004 0.0 -1 1 {} H 0.0 {0.735803 0.452869 0.468415} H32 2005 0.0 -1 1 {} H 0.0 {0.511042 0.501718 0.770542} H33 2006 0.0 -1 1 {} H 0.0 {0.722006 0.451683 0.402395} H34 2007 0.0 -1 7 {} N 0.0 {0.806525 0.47588 0.437617} N3 2008 0.0 -1 1 {} H 0.0 {0.807772 0.48608 0.435777} H16 2009 0.0 -1 1 {} H 0.0 {0.807013 0.474601 0.44765} H17 2010 0.0 -1 7 {} N 0.0 {0.41957 0.307782 0.31804} N6 2011 0.0 -1 1 {} H 0.0 {0.411819 0.309919 0.311278} H41 2012 0.0 -1 1 {} H 0.0 {0.426183 0.300745 0.314721} H42 2013 0.0 -1 14 {} Si 0.0 {0.7105 0.312218 0.47532} Si6 2014 0.0 -1 8 {} O 0.0 {0.695917 0.315214 0.470718} O6 2015 0.0 -1 14 {} Si 0.0 {0.685887 0.319551 0.458687} Si7 2016 0.0 -1 8 {} O 0.0 {0.679442 0.305603 0.455985} O7 2017 0.0 -1 14 {} Si 0.0 {0.667483 0.2949 0.45594} Si8 2018 0.0 -1 7 {} N 0.0 {0.669149 0.276275 0.46311} N2 2019 0.0 -1 14 {} Si 0.0 {0.679421 0.285995 0.477096} Si9 2020 0.0 -1 14 {} Si 0.0 {0.6558 0.26318 0.455959} Si10 2021 0.0 -1 6 {} C 0.0 {0.717746 0.321085 0.490196} C3 2022 0.0 -1 7 {} N 0.0 {0.673798 0.33421 0.463802} N 2023 0.0 -1 8 {} O 0.0 {0.694321 0.320502 0.444733} O8 2024 0.0 -1 8 {} O 0.0 {0.716814 0.312617 0.461056} O9 2025 0.0 -1 8 {} O 0.0 {0.709578 0.292506 0.471819} O10 2026 0.0 -1 1 {} H 0.0 {0.677656 0.272824 0.458353} H18 2027 0.0 -1 1 {} H 0.0 {0.656741 0.300261 0.464166} H19 2028 0.0 -1 1 {} H 0.0 {0.69624 0.28976 0.473192} H20 2029 0.0 -1 1 {} H 0.0 {0.674872 0.302062 0.477134} H22 2030 0.0 -1 1 {} H 0.0 {0.645024 0.256748 0.463211} H24 2031 0.0 -1 1 {} H 0.0 {0.646744 0.271701 0.446814} H25 2032 0.0 -1 1 {} H 0.0 {0.711154 0.330005 0.490623} H26 2033 0.0 -1 1 {} H 0.0 {0.727806 0.323138 0.488387} H27 2034 0.0 -1 1 {} H 0.0 {0.7162 0.315403 0.498781} H28 2035 0.0 -1 1 {} H 0.0 {0.681781 0.34068 0.463564} H29 2036 0.0 -1 1 {} H 0.0 {0.672148 0.332311 0.473723} H31 2037 0.0 -1 1 {} H 0.0 {0.692349 0.312545 0.439601} H32 2038 0.0 -1 1 {} H 0.0 {0.709884 0.315095 0.453911} H33 2039 0.0 -1 1 {} H 0.0 {0.710543 0.293904 0.462295} H34 2040 0.0 -1 7 {} N 0.0 {0.677457 0.274839 0.494466} N3 2041 0.0 -1 1 {} H 0.0 {0.66866 0.269864 0.493022} H16 2042 0.0 -1 1 {} H 0.0 {0.686963 0.277581 0.49633} H17 2043 0.0 -1 7 {} N 0.0 {0.655618 0.257088 0.394743} N6 2044 0.0 -1 1 {} H 0.0 {0.653866 0.250186 0.401596} H41 2045 0.0 -1 1 {} H 0.0 {0.650428 0.254793 0.386365} H42 2046 0.0 -1 14 {} Si 0.0 {0.384292 0.470093 0.383887} Si6 2047 0.0 -1 8 {} O 0.0 {0.368812 0.468507 0.381551} O6 2048 0.0 -1 14 {} Si 0.0 {0.355622 0.472938 0.373805} Si7 2049 0.0 -1 8 {} O 0.0 {0.361031 0.486466 0.367318} O7 2050 0.0 -1 14 {} Si 0.0 {0.36098 0.498405 0.357236} Si8 2051 0.0 -1 7 {} N 0.0 {0.373253 0.508741 0.356223} N2 2052 0.0 -1 14 {} Si 0.0 {0.38782 0.499962 0.355738} Si9 2053 0.0 -1 14 {} Si 0.0 {0.378204 0.524133 0.353797} Si10 2054 0.0 -1 6 {} C 0.0 {0.393715 0.458847 0.395675} C3 2055 0.0 -1 7 {} N 0.0 {0.344617 0.461621 0.366397} N 2056 0.0 -1 8 {} O 0.0 {0.343014 0.481583 0.387613} O8 2057 0.0 -1 8 {} O 0.0 {0.384211 0.488666 0.385447} O9 2058 0.0 -1 8 {} O 0.0 {0.389183 0.470495 0.365451} O10 2059 0.0 -1 1 {} H 0.0 {0.353464 0.49224 0.343662} H18 2060 0.0 -1 1 {} H 0.0 {0.371138 0.514441 0.423981} H19 2061 0.0 -1 1 {} H 0.0 {0.401298 0.509691 0.362796} H20 2062 0.0 -1 1 {} H 0.0 {0.385548 0.483188 0.360811} H22 2063 0.0 -1 1 {} H 0.0 {0.373264 0.533409 0.367463} H24 2064 0.0 -1 1 {} H 0.0 {0.368142 0.52997 0.340678} H25 2065 0.0 -1 1 {} H 0.0 {0.386247 0.454746 0.402124} H26 2066 0.0 -1 1 {} H 0.0 {0.399155 0.465359 0.402194} H27 2067 0.0 -1 1 {} H 0.0 {0.398918 0.452056 0.38962} H28 2068 0.0 -1 1 {} H 0.0 {0.335075 0.463326 0.369792} H29 2069 0.0 -1 1 {} H 0.0 {0.347239 0.45214 0.3697} H31 2070 0.0 -1 1 {} H 0.0 {0.337903 0.487313 0.382539} H32 2071 0.0 -1 1 {} H 0.0 {0.377254 0.491529 0.378982} H33 2072 0.0 -1 1 {} H 0.0 {0.381473 0.465104 0.361295} H34 2073 0.0 -1 7 {} N 0.0 {0.39222 0.496403 0.336736} N3 2074 0.0 -1 1 {} H 0.0 {0.402128 0.495371 0.336248} H16 2075 0.0 -1 1 {} H 0.0 {0.390561 0.505564 0.332352} H17 2076 0.0 -1 7 {} N 0.0 {0.394685 0.529786 0.344571} N6 2077 0.0 -1 1 {} H 0.0 {0.396228 0.521426 0.338747} H41 2078 0.0 -1 1 {} H 0.0 {0.400474 0.528005 0.352719} H42 2079 0.0 -1 14 {} Si 0.0 {0.623226 0.618961 0.390934} Si6 2080 0.0 -1 8 {} O 0.0 {0.644523 0.674704 0.328997} O6 2081 0.0 -1 14 {} Si 0.0 {0.630874 0.685628 0.331708} Si7 2082 0.0 -1 8 {} O 0.0 {0.633876 0.686281 0.347029} O7 2083 0.0 -1 14 {} Si 0.0 {0.632305 0.683852 0.362585} Si8 2084 0.0 -1 7 {} N 0.0 {0.633314 0.667205 0.371636} N2 2085 0.0 -1 14 {} Si 0.0 {0.636505 0.647461 0.376541} Si9 2086 0.0 -1 14 {} Si 0.0 {0.647496 0.662531 0.35825} Si10 2087 0.0 -1 6 {} C 0.0 {0.628887 0.625096 0.375506} C3 2088 0.0 -1 7 {} N 0.0 {0.624157 0.698002 0.320917} N 2089 0.0 -1 8 {} O 0.0 {0.619152 0.673082 0.332712} O8 2090 0.0 -1 8 {} O 0.0 {0.619609 0.626972 0.403863} O9 2091 0.0 -1 8 {} O 0.0 {0.613894 0.602611 0.396145} O10 2092 0.0 -1 1 {} H 0.0 {0.637582 0.693516 0.370084} H18 2093 0.0 -1 1 {} H 0.0 {0.615125 0.684522 0.365424} H19 2094 0.0 -1 1 {} H 0.0 {0.627621 0.658345 0.401982} H20 2095 0.0 -1 1 {} H 0.0 {0.622171 0.648382 0.380683} H22 2096 0.0 -1 1 {} H 0.0 {0.64039 0.685876 0.38957} H24 2097 0.0 -1 1 {} H 0.0 {0.660761 0.666727 0.363961} H25 2098 0.0 -1 1 {} H 0.0 {0.637664 0.619334 0.372655} H26 2099 0.0 -1 1 {} H 0.0 {0.620682 0.625129 0.367891} H27 2100 0.0 -1 1 {} H 0.0 {0.667143 0.607551 0.43399} H28 2101 0.0 -1 1 {} H 0.0 {0.627541 0.707065 0.324147} H29 2102 0.0 -1 1 {} H 0.0 {0.628247 0.695913 0.311456} H31 2103 0.0 -1 1 {} H 0.0 {0.620862 0.666712 0.325381} H32 2104 0.0 -1 1 {} H 0.0 {0.650335 0.579423 0.371618} H33 2105 0.0 -1 1 {} H 0.0 {0.618569 0.596328 0.39033} H34 2106 0.0 -1 7 {} N 0.0 {0.644412 0.641451 0.358267} N3 2107 0.0 -1 1 {} H 0.0 {0.636121 0.638124 0.353276} H16 2108 0.0 -1 1 {} H 0.0 {0.653607 0.637683 0.361398} H17 2109 0.0 -1 7 {} N 0.0 {0.633203 0.481787 0.66082} N6 2110 0.0 -1 1 {} H 0.0 {0.580947 0.333986 0.769047} H41 2111 0.0 -1 1 {} H 0.0 {0.585887 0.368014 0.760962} H42 2112 0.0 -1 14 {} Si 0.0 {0.300449 0.347308 0.502679} Si6 2113 0.0 -1 8 {} O 0.0 {0.302307 0.33343 0.495025} O6 2114 0.0 -1 14 {} Si 0.0 {0.310973 0.32085 0.500512} Si7 2115 0.0 -1 8 {} O 0.0 {0.328785 0.343589 0.491555} O7 2116 0.0 -1 14 {} Si 0.0 {0.331887 0.32931 0.486261} Si8 2117 0.0 -1 7 {} N 0.0 {0.634566 0.546222 0.636946} N2 2118 0.0 -1 14 {} Si 0.0 {0.631027 0.536638 0.655281} Si9 2119 0.0 -1 14 {} Si 0.0 {0.3218 0.356971 0.495883} Si10 2120 0.0 -1 6 {} C 0.0 {0.296235 0.351154 0.520479} C3 2121 0.0 -1 7 {} N 0.0 {0.591687 0.600582 0.260089} N 2122 0.0 -1 8 {} O 0.0 {0.323589 0.331414 0.473403} O8 2123 0.0 -1 8 {} O 0.0 {0.31416 0.364638 0.484757} O9 2124 0.0 -1 8 {} O 0.0 {0.324622 0.364395 0.510201} O10 2125 0.0 -1 1 {} H 0.0 {0.424921 0.135373 0.777394} H18 2126 0.0 -1 1 {} H 0.0 {0.344979 0.329317 0.481058} H19 2127 0.0 -1 1 {} H 0.0 {0.639965 0.541877 0.665604} H20 2128 0.0 -1 1 {} H 0.0 {0.633628 0.537318 0.631889} H22 2129 0.0 -1 1 {} H 0.0 {0.58525 0.470921 0.71294} H24 2130 0.0 -1 1 {} H 0.0 {0.520601 0.688798 0.366923} H25 2131 0.0 -1 1 {} H 0.0 {0.295286 0.342164 0.52588} H26 2132 0.0 -1 1 {} H 0.0 {0.286887 0.356296 0.520386} H27 2133 0.0 -1 1 {} H 0.0 {0.303558 0.356739 0.525229} H28 2134 0.0 -1 1 {} H 0.0 {0.589487 0.594337 0.251956} H29 2135 0.0 -1 1 {} H 0.0 {0.591473 0.610184 0.256829} H31 2136 0.0 -1 1 {} H 0.0 {0.336041 0.350846 0.470156} H32 2137 0.0 -1 1 {} H 0.0 {0.318562 0.363314 0.475958} H33 2138 0.0 -1 1 {} H 0.0 {0.333068 0.359905 0.513815} H34 2139 0.0 -1 7 {} N 0.0 {0.632864 0.519251 0.655285} N3 2140 0.0 -1 1 {} H 0.0 {0.629362 0.516592 0.645643} H16 2141 0.0 -1 1 {} H 0.0 {0.625949 0.514999 0.661232} H17 2142 0.0 -1 7 {} N 0.0 {0.434158 0.232831 0.475487} N6 2143 0.0 -1 1 {} H 0.0 {0.43889 0.223152 0.475588} H41 2144 0.0 -1 1 {} H 0.0 {0.640925 0.666192 0.325682} H42 2145 0.0 -1 14 {} Si 0.0 {0.257784 0.600768 0.452399} Si6 2146 0.0 -1 8 {} O 0.0 {0.257564 0.594748 0.466713} O6 2147 0.0 -1 14 {} Si 0.0 {0.252656 0.594401 0.481828} Si7 2148 0.0 -1 8 {} O 0.0 {0.238233 0.598157 0.476847} O7 2149 0.0 -1 14 {} Si 0.0 {0.223723 0.592761 0.474966} Si8 2150 0.0 -1 7 {} N 0.0 {0.210932 0.588059 0.484115} N2 2151 0.0 -1 14 {} Si 0.0 {0.204638 0.568796 0.485169} Si9 2152 0.0 -1 14 {} Si 0.0 {0.199197 0.591066 0.49387} Si10 2153 0.0 -1 6 {} C 0.0 {0.245434 0.595319 0.439253} C3 2154 0.0 -1 7 {} N 0.0 {0.258297 0.58289 0.494466} N 2155 0.0 -1 8 {} O 0.0 {0.259037 0.614312 0.484142} O8 2156 0.0 -1 8 {} O 0.0 {0.277523 0.595923 0.450394} O9 2157 0.0 -1 8 {} O 0.0 {0.261976 0.615894 0.455697} O10 2158 0.0 -1 1 {} H 0.0 {0.218961 0.601821 0.462157} H18 2159 0.0 -1 1 {} H 0.0 {0.226068 0.576356 0.468198} H19 2160 0.0 -1 1 {} H 0.0 {0.19522 0.54924 0.51209} H20 2161 0.0 -1 1 {} H 0.0 {0.220639 0.565197 0.487905} H22 2162 0.0 -1 1 {} H 0.0 {0.196771 0.557819 0.497045} H24 2163 0.0 -1 1 {} H 0.0 {0.482391 0.590893 0.563906} H25 2164 0.0 -1 1 {} H 0.0 {0.236238 0.60008 0.440622} H26 2165 0.0 -1 1 {} H 0.0 {0.245032 0.585083 0.438009} H27 2166 0.0 -1 1 {} H 0.0 {0.2492 0.599535 0.430039} H28 2167 0.0 -1 1 {} H 0.0 {0.257566 0.588167 0.503365} H29 2168 0.0 -1 1 {} H 0.0 {0.268404 0.581888 0.492789} H31 2169 0.0 -1 1 {} H 0.0 {0.258941 0.616733 0.474493} H32 2170 0.0 -1 1 {} H 0.0 {0.281316 0.602897 0.45646} H33 2171 0.0 -1 1 {} H 0.0 {0.265387 0.619394 0.447389} H34 2172 0.0 -1 7 {} N 0.0 {0.20001 0.562393 0.471409} N3 2173 0.0 -1 1 {} H 0.0 {0.507001 0.696416 0.554228} H16 2174 0.0 -1 1 {} H 0.0 {0.195715 0.569826 0.465821} H17 2175 0.0 -1 7 {} N 0.0 {0.183477 0.599677 0.486055} N6 2176 0.0 -1 1 {} H 0.0 {0.500383 0.770319 0.596446} H41 2177 0.0 -1 1 {} H 0.0 {0.179827 0.604269 0.494479} H42 2178 0.0 -1 14 {} Si 0.0 {0.682275 0.307769 0.543065} Si6 2179 0.0 -1 8 {} O 0.0 {0.686555 0.303554 0.498057} O6 2180 0.0 -1 14 {} Si 0.0 {0.668647 0.293983 0.497573} Si7 2181 0.0 -1 8 {} O 0.0 {0.664057 0.30485 0.486751} O7 2182 0.0 -1 14 {} Si 0.0 {0.553702 0.682154 0.328031} Si8 2183 0.0 -1 7 {} N 0.0 {0.602748 0.301643 0.553033} N2 2184 0.0 -1 14 {} Si 0.0 {0.618081 0.298179 0.54189} Si9 2185 0.0 -1 14 {} Si 0.0 {0.547531 0.690704 0.352004} Si10 2186 0.0 -1 6 {} C 0.0 {0.68477 0.308342 0.52573} C3 2187 0.0 -1 7 {} N 0.0 {0.655653 0.290189 0.509051} N 2188 0.0 -1 8 {} O 0.0 {0.602093 0.685051 0.366173} O8 2189 0.0 -1 8 {} O 0.0 {0.689023 0.297399 0.554006} O9 2190 0.0 -1 8 {} O 0.0 {0.684898 0.323089 0.554171} O10 2191 0.0 -1 1 {} H 0.0 {0.560531 0.671336 0.330335} H18 2192 0.0 -1 1 {} H 0.0 {0.530742 0.657279 0.323401} H19 2193 0.0 -1 1 {} H 0.0 {0.629134 0.304866 0.543994} H20 2194 0.0 -1 1 {} H 0.0 {0.686764 0.308212 0.489179} H22 2195 0.0 -1 1 {} H 0.0 {0.595412 0.302984 0.545707} H24 2196 0.0 -1 1 {} H 0.0 {0.550234 0.686284 0.339479} H25 2197 0.0 -1 1 {} H 0.0 {0.678093 0.301685 0.52194} H26 2198 0.0 -1 1 {} H 0.0 {0.629434 0.645316 0.40926} H27 2199 0.0 -1 1 {} H 0.0 {0.695325 0.307241 0.52474} H28 2200 0.0 -1 1 {} H 0.0 {0.646559 0.292648 0.504988} H29 2201 0.0 -1 1 {} H 0.0 {0.600928 0.677027 0.360496} H31 2202 0.0 -1 1 {} H 0.0 {0.599827 0.691956 0.359479} H32 2203 0.0 -1 1 {} H 0.0 {0.694461 0.302902 0.56011} H33 2204 0.0 -1 1 {} H 0.0 {0.680267 0.330618 0.549443} H34 2205 0.0 -1 7 {} N 0.0 {0.625242 0.279747 0.538425} N3 2206 0.0 -1 1 {} H 0.0 {0.621288 0.278576 0.528774} H16 2207 0.0 -1 1 {} H 0.0 {0.635244 0.281213 0.53668} H17 2208 0.0 -1 7 {} N 0.0 {0.533896 0.698932 0.351697} N6 2209 0.0 -1 1 {} H 0.0 {0.652461 0.298223 0.530964} H41 2210 0.0 -1 1 {} H 0.0 {0.528797 0.698607 0.343284} H42 2211 0.0 -1 14 {} Si 0.0 {0.505209 0.335528 0.684571} Si6 2212 0.0 -1 8 {} O 0.0 {0.511536 0.337489 0.698431} O6 2213 0.0 -1 14 {} Si 0.0 {0.51415 0.333246 0.713516} Si7 2214 0.0 -1 8 {} O 0.0 {0.53855 0.322034 0.727169} O7 2215 0.0 -1 14 {} Si 0.0 {0.53285 0.317628 0.70735} Si8 2216 0.0 -1 7 {} N 0.0 {0.531745 0.302342 0.700186} N2 2217 0.0 -1 14 {} Si 0.0 {0.518904 0.29094 0.700526} Si9 2218 0.0 -1 14 {} Si 0.0 {0.542237 0.285291 0.70338} Si10 2219 0.0 -1 6 {} C 0.0 {0.503067 0.350962 0.673976} C3 2220 0.0 -1 7 {} N 0.0 {0.51996 0.344374 0.726265} N 2221 0.0 -1 8 {} O 0.0 {0.506121 0.320252 0.715671} O8 2222 0.0 -1 8 {} O 0.0 {0.493571 0.325411 0.687281} O9 2223 0.0 -1 8 {} O 0.0 {0.517543 0.320441 0.678451} O10 2224 0.0 -1 1 {} H 0.0 {0.530099 0.329305 0.698715} H18 2225 0.0 -1 1 {} H 0.0 {0.547835 0.27925 0.724944} H19 2226 0.0 -1 1 {} H 0.0 {0.390301 0.680536 0.627491} H20 2227 0.0 -1 1 {} H 0.0 {0.329614 0.602669 0.547781} H22 2228 0.0 -1 1 {} H 0.0 {0.570944 0.432718 0.78225} H24 2229 0.0 -1 1 {} H 0.0 {0.528051 0.276505 0.70214} H25 2230 0.0 -1 1 {} H 0.0 {0.49917 0.347741 0.664847} H26 2231 0.0 -1 1 {} H 0.0 {0.513187 0.354626 0.6726} H27 2232 0.0 -1 1 {} H 0.0 {0.498288 0.35831 0.679582} H28 2233 0.0 -1 1 {} H 0.0 {0.52677 0.339949 0.732368} H29 2234 0.0 -1 1 {} H 0.0 {0.525321 0.351473 0.721234} H31 2235 0.0 -1 1 {} H 0.0 {0.506395 0.305406 0.714526} H32 2236 0.0 -1 1 {} H 0.0 {0.492093 0.325428 0.697127} H33 2237 0.0 -1 1 {} H 0.0 {0.518672 0.312841 0.684927} H34 2238 0.0 -1 7 {} N 0.0 {0.509142 0.288351 0.68422} N3 2239 0.0 -1 1 {} H 0.0 {0.48277 0.617255 0.555248} H16 2240 0.0 -1 1 {} H 0.0 {0.502179 0.295512 0.685906} H17 2241 0.0 -1 7 {} N 0.0 {0.555167 0.285615 0.690425} N6 2242 0.0 -1 1 {} H 0.0 {0.493707 0.625629 0.588651} H41 2243 0.0 -1 1 {} H 0.0 {0.549885 0.282043 0.682472} H42 2244 0.0 -1 14 {} Si 0.0 {0.337154 0.450668 0.657336} Si6 2245 0.0 -1 8 {} O 0.0 {0.341214 0.443873 0.671608} O6 2246 0.0 -1 14 {} Si 0.0 {0.34939 0.434931 0.682065} Si7 2247 0.0 -1 8 {} O 0.0 {0.362012 0.433581 0.672753} O7 2248 0.0 -1 14 {} Si 0.0 {0.373526 0.440567 0.66434} Si8 2249 0.0 -1 7 {} N 0.0 {0.385916 0.450354 0.669184} N2 2250 0.0 -1 14 {} Si 0.0 {0.384031 0.449469 0.685838} Si9 2251 0.0 -1 14 {} Si 0.0 {0.399948 0.458141 0.666556} Si10 2252 0.0 -1 6 {} C 0.0 {0.330137 0.442239 0.644389} C3 2253 0.0 -1 7 {} N 0.0 {0.349076 0.441417 0.700074} N 2254 0.0 -1 8 {} O 0.0 {0.344228 0.419653 0.680223} O8 2255 0.0 -1 8 {} O 0.0 {0.353783 0.461045 0.652926} O9 2256 0.0 -1 8 {} O 0.0 {0.329427 0.465811 0.668025} O10 2257 0.0 -1 1 {} H 0.0 {0.376446 0.430122 0.650349} H18 2258 0.0 -1 1 {} H 0.0 {0.362369 0.453674 0.658083} H19 2259 0.0 -1 1 {} H 0.0 {0.380872 0.400389 0.694408} H20 2260 0.0 -1 1 {} H 0.0 {0.376141 0.460867 0.69051} H22 2261 0.0 -1 1 {} H 0.0 {0.407374 0.446929 0.656796} H24 2262 0.0 -1 1 {} H 0.0 {0.410311 0.460767 0.67951} H25 2263 0.0 -1 1 {} H 0.0 {0.320393 0.440014 0.646788} H26 2264 0.0 -1 1 {} H 0.0 {0.354055 0.429699 0.635499} H27 2265 0.0 -1 1 {} H 0.0 {0.330495 0.448214 0.635661} H28 2266 0.0 -1 1 {} H 0.0 {0.341634 0.44795 0.69913} H29 2267 0.0 -1 1 {} H 0.0 {0.345193 0.43439 0.705684} H31 2268 0.0 -1 1 {} H 0.0 {0.339373 0.419313 0.672152} H32 2269 0.0 -1 1 {} H 0.0 {0.354063 0.469086 0.658912} H33 2270 0.0 -1 1 {} H 0.0 {0.329809 0.462244 0.676601} H34 2271 0.0 -1 7 {} N 0.0 {0.397055 0.439449 0.695688} N3 2272 0.0 -1 1 {} H 0.0 {0.39377 0.430262 0.692083} H16 2273 0.0 -1 1 {} H 0.0 {0.393187 0.439425 0.705073} H17 2274 0.0 -1 7 {} N 0.0 {0.394709 0.473548 0.656531} N6 2275 0.0 -1 1 {} H 0.0 {0.38599 0.477153 0.661081} H41 2276 0.0 -1 1 {} H 0.0 {0.390511 0.469183 0.648127} H42 2277 0.0 -1 14 {} Si 0.0 {0.392168 0.298461 0.437931} Si6 2278 0.0 -1 8 {} O 0.0 {0.413993 0.305364 0.446353} O6 2279 0.0 -1 14 {} Si 0.0 {0.42736 0.313738 0.44556} Si7 2280 0.0 -1 8 {} O 0.0 {0.437645 0.302384 0.43869} O7 2281 0.0 -1 14 {} Si 0.0 {0.411487 0.282701 0.427331} Si8 2282 0.0 -1 7 {} N 0.0 {0.418866 0.268466 0.432886} N2 2283 0.0 -1 14 {} Si 0.0 {0.427246 0.280807 0.464091} Si9 2284 0.0 -1 14 {} Si 0.0 {0.424763 0.260481 0.446813} Si10 2285 0.0 -1 6 {} C 0.0 {0.401191 0.314474 0.437494} C3 2286 0.0 -1 7 {} N 0.0 {0.430047 0.329593 0.438423} N 2287 0.0 -1 8 {} O 0.0 {0.433627 0.311022 0.464549} O8 2288 0.0 -1 8 {} O 0.0 {0.389588 0.289027 0.450258} O9 2289 0.0 -1 8 {} O 0.0 {0.3854 0.290699 0.425744} O10 2290 0.0 -1 1 {} H 0.0 {0.437362 0.303828 0.428973} H18 2291 0.0 -1 1 {} H 0.0 {0.417408 0.289006 0.41622} H19 2292 0.0 -1 1 {} H 0.0 {0.441008 0.279693 0.470682} H20 2293 0.0 -1 1 {} H 0.0 {0.430837 0.291584 0.454304} H22 2294 0.0 -1 1 {} H 0.0 {0.426939 0.267798 0.426087} H24 2295 0.0 -1 1 {} H 0.0 {0.415093 0.251748 0.453121} H25 2296 0.0 -1 1 {} H 0.0 {0.385208 0.332737 0.379443} H26 2297 0.0 -1 1 {} H 0.0 {0.402132 0.318394 0.427842} H27 2298 0.0 -1 1 {} H 0.0 {0.395278 0.320941 0.44381} H28 2299 0.0 -1 1 {} H 0.0 {0.421458 0.335129 0.437338} H29 2300 0.0 -1 1 {} H 0.0 {0.433136 0.327893 0.428824} H31 2301 0.0 -1 1 {} H 0.0 {0.426192 0.311441 0.470142} H32 2302 0.0 -1 1 {} H 0.0 {0.397123 0.287214 0.455829} H33 2303 0.0 -1 1 {} H 0.0 {0.395137 0.281749 0.422896} H34 2304 0.0 -1 7 {} N 0.0 {0.41258 0.285918 0.473896} N3 2305 0.0 -1 1 {} H 0.0 {0.413763 0.280399 0.482104} H16 2306 0.0 -1 1 {} H 0.0 {0.41366 0.295597 0.476931} H17 2307 0.0 -1 7 {} N 0.0 {0.442721 0.25226 0.441059} N6 2308 0.0 -1 1 {} H 0.0 {0.445072 0.261656 0.436288} H41 2309 0.0 -1 1 {} H 0.0 {0.438333 0.246932 0.433342} H42 2310 0.0 -1 14 {} Si 0.0 {0.509578 0.531112 0.431695} Si6 2311 0.0 -1 8 {} O 0.0 {0.513561 0.517556 0.424723} O6 2312 0.0 -1 14 {} Si 0.0 {0.51597 0.501994 0.425291} Si7 2313 0.0 -1 8 {} O 0.0 {0.508884 0.49781 0.411691} O7 2314 0.0 -1 14 {} Si 0.0 {0.499093 0.502425 0.400024} Si8 2315 0.0 -1 7 {} N 0.0 {0.497331 0.519342 0.390693} N2 2316 0.0 -1 14 {} Si 0.0 {0.483615 0.527935 0.387267} Si9 2317 0.0 -1 14 {} Si 0.0 {0.510215 0.529478 0.391169} Si10 2318 0.0 -1 6 {} C 0.0 {0.520951 0.538368 0.444395} C3 2319 0.0 -1 7 {} N 0.0 {0.531199 0.49566 0.431045} N 2320 0.0 -1 8 {} O 0.0 {0.499283 0.496968 0.436762} O8 2321 0.0 -1 8 {} O 0.0 {0.495656 0.525033 0.435805} O9 2322 0.0 -1 8 {} O 0.0 {0.503545 0.543309 0.416274} O10 2323 0.0 -1 1 {} H 0.0 {0.492155 0.490096 0.393819} H18 2324 0.0 -1 1 {} H 0.0 {0.484149 0.509307 0.407273} H19 2325 0.0 -1 1 {} H 0.0 {0.477072 0.531876 0.401014} H20 2326 0.0 -1 1 {} H 0.0 {0.485427 0.540606 0.378464} H22 2327 0.0 -1 1 {} H 0.0 {0.524744 0.519596 0.393234} H24 2328 0.0 -1 1 {} H 0.0 {0.507854 0.537648 0.405522} H25 2329 0.0 -1 1 {} H 0.0 {0.528082 0.531592 0.447242} H26 2330 0.0 -1 1 {} H 0.0 {0.514976 0.542542 0.452809} H27 2331 0.0 -1 1 {} H 0.0 {0.52588 0.546586 0.439662} H28 2332 0.0 -1 1 {} H 0.0 {0.538584 0.501383 0.426074} H29 2333 0.0 -1 1 {} H 0.0 {0.531561 0.485804 0.427427} H31 2334 0.0 -1 1 {} H 0.0 {0.495047 0.50558 0.437256} H32 2335 0.0 -1 1 {} H 0.0 {0.488558 0.528445 0.429507} H33 2336 0.0 -1 1 {} H 0.0 {0.508739 0.550989 0.417786} H34 2337 0.0 -1 7 {} N 0.0 {0.472351 0.517894 0.375071} N3 2338 0.0 -1 1 {} H 0.0 {0.474827 0.508631 0.37827} H16 2339 0.0 -1 1 {} H 0.0 {0.475928 0.520037 0.366233} H17 2340 0.0 -1 7 {} N 0.0 {0.513423 0.540712 0.376023} N6 2341 0.0 -1 1 {} H 0.0 {0.515756 0.533569 0.368904} H41 2342 0.0 -1 1 {} H 0.0 {0.504442 0.544448 0.374719} H42 2343 0.0 -1 14 {} Si 0.0 {0.63895 0.279821 0.438752} Si6 2344 0.0 -1 8 {} O 0.0 {0.648247 0.273248 0.402107} O6 2345 0.0 -1 14 {} Si 0.0 {0.65942 0.283099 0.406642} Si7 2346 0.0 -1 8 {} O 0.0 {0.656785 0.296769 0.397619} O7 2347 0.0 -1 14 {} Si 0.0 {0.647417 0.289502 0.387745} Si8 2348 0.0 -1 7 {} N 0.0 {0.425993 0.333826 0.759042} N2 2349 0.0 -1 14 {} Si 0.0 {0.424426 0.332887 0.742714} Si9 2350 0.0 -1 14 {} Si 0.0 {0.421478 0.357637 0.730743} Si10 2351 0.0 -1 6 {} C 0.0 {0.629534 0.268008 0.427207} C3 2352 0.0 -1 7 {} N 0.0 {0.531004 0.713987 0.379974} N 2353 0.0 -1 8 {} O 0.0 {0.659148 0.251193 0.44622} O8 2354 0.0 -1 8 {} O 0.0 {0.651107 0.294434 0.432439} O9 2355 0.0 -1 8 {} O 0.0 {0.629313 0.287675 0.449653} O10 2356 0.0 -1 1 {} H 0.0 {0.655503 0.285341 0.37799} H18 2357 0.0 -1 1 {} H 0.0 {0.61313 0.315428 0.390412} H19 2358 0.0 -1 1 {} H 0.0 {0.43535 0.325256 0.735929} H20 2359 0.0 -1 1 {} H 0.0 {0.522385 0.715972 0.375857} H22 2360 0.0 -1 1 {} H 0.0 {0.432088 0.367111 0.733592} H24 2361 0.0 -1 1 {} H 0.0 {0.409722 0.362208 0.736075} H25 2362 0.0 -1 1 {} H 0.0 {0.637072 0.261032 0.423745} H26 2363 0.0 -1 1 {} H 0.0 {0.626615 0.274027 0.418933} H27 2364 0.0 -1 1 {} H 0.0 {0.621752 0.264087 0.433043} H28 2365 0.0 -1 1 {} H 0.0 {0.536711 0.71027 0.371809} H29 2366 0.0 -1 1 {} H 0.0 {0.534863 0.723115 0.38207} H31 2367 0.0 -1 1 {} H 0.0 {0.672868 0.278912 0.402107} H32 2368 0.0 -1 1 {} H 0.0 {0.656709 0.290129 0.424123} H33 2369 0.0 -1 1 {} H 0.0 {0.627746 0.296672 0.446579} H34 2370 0.0 -1 7 {} N 0.0 {0.520236 0.374157 0.718924} N3 2371 0.0 -1 1 {} H 0.0 {0.521084 0.382009 0.712703} H16 2372 0.0 -1 1 {} H 0.0 {0.515134 0.366948 0.714026} H17 2373 0.0 -1 7 {} N 0.0 {0.420259 0.355134 0.711204} N6 2374 0.0 -1 1 {} H 0.0 {0.421841 0.344671 0.709453} H41 2375 0.0 -1 1 {} H 0.0 {0.410576 0.357915 0.71026} H42 2376 0.0 -1 14 {} Si 0.0 {0.560843 0.329406 0.581682} Si6 2377 0.0 -1 8 {} O 0.0 {0.570353 0.335153 0.57073} O6 2378 0.0 -1 14 {} Si 0.0 {0.572629 0.337238 0.555695} Si7 2379 0.0 -1 8 {} O 0.0 {0.560732 0.347047 0.55256} O7 2380 0.0 -1 14 {} Si 0.0 {0.553141 0.360142 0.55162} Si8 2381 0.0 -1 7 {} N 0.0 {0.55076 0.369469 0.534295} N2 2382 0.0 -1 14 {} Si 0.0 {0.543882 0.382415 0.527535} Si9 2383 0.0 -1 14 {} Si 0.0 {0.549239 0.355725 0.52619} Si10 2384 0.0 -1 6 {} C 0.0 {0.541884 0.331063 0.583298} C3 2385 0.0 -1 7 {} N 0.0 {0.589612 0.338561 0.549026} N 2386 0.0 -1 8 {} O 0.0 {0.564351 0.319487 0.548683} O8 2387 0.0 -1 8 {} O 0.0 {0.5708 0.318407 0.588404} O9 2388 0.0 -1 8 {} O 0.0 {0.528719 0.324875 0.618515} O10 2389 0.0 -1 1 {} H 0.0 {0.538956 0.358106 0.558911} H18 2390 0.0 -1 1 {} H 0.0 {0.558975 0.369333 0.563683} H19 2391 0.0 -1 1 {} H 0.0 {0.541141 0.380073 0.511586} H20 2392 0.0 -1 1 {} H 0.0 {0.529067 0.384375 0.535302} H22 2393 0.0 -1 1 {} H 0.0 {0.536147 0.347142 0.524086} H24 2394 0.0 -1 1 {} H 0.0 {0.594502 0.342776 0.506307} H25 2395 0.0 -1 1 {} H 0.0 {0.53895 0.330737 0.593849} H26 2396 0.0 -1 1 {} H 0.0 {0.537437 0.322784 0.577789} H27 2397 0.0 -1 1 {} H 0.0 {0.538937 0.340517 0.578532} H28 2398 0.0 -1 1 {} H 0.0 {0.595427 0.331967 0.554774} H29 2399 0.0 -1 1 {} H 0.0 {0.589699 0.33449 0.53951} H31 2400 0.0 -1 1 {} H 0.0 {0.569156 0.316322 0.541263} H32 2401 0.0 -1 1 {} H 0.0 {0.528865 0.315021 0.61674} H33 2402 0.0 -1 1 {} H 0.0 {0.524632 0.327721 0.609083} H34 2403 0.0 -1 7 {} N 0.0 {0.554204 0.397619 0.533013} N3 2404 0.0 -1 1 {} H 0.0 {0.554809 0.401671 0.52403} H16 2405 0.0 -1 1 {} H 0.0 {0.548679 0.403659 0.538926} H17 2406 0.0 -1 7 {} N 0.0 {0.556955 0.349681 0.508656} N6 2407 0.0 -1 1 {} H 0.0 {0.564208 0.34291 0.511988} H41 2408 0.0 -1 1 {} H 0.0 {0.563454 0.358096 0.507799} H42 2409 0.0 -1 14 {} Si 0.0 {0.61791 0.482066 0.574581} Si6 2410 0.0 -1 8 {} O 0.0 {0.614887 0.497156 0.576528} O6 2411 0.0 -1 14 {} Si 0.0 {0.617056 0.512621 0.574376} Si7 2412 0.0 -1 8 {} O 0.0 {0.628621 0.513278 0.58484} O7 2413 0.0 -1 14 {} Si 0.0 {0.644469 0.515475 0.588506} Si8 2414 0.0 -1 7 {} N 0.0 {0.657649 0.530165 0.58263} N2 2415 0.0 -1 14 {} Si 0.0 {0.66542 0.545447 0.571774} Si9 2416 0.0 -1 14 {} Si 0.0 {0.401329 0.314947 0.396611} Si10 2417 0.0 -1 6 {} C 0.0 {0.623578 0.469812 0.587749} C3 2418 0.0 -1 7 {} N 0.0 {0.615632 0.518024 0.558044} N 2419 0.0 -1 8 {} O 0.0 {0.59813 0.515165 0.58308} O8 2420 0.0 -1 8 {} O 0.0 {0.628991 0.482086 0.559694} O9 2421 0.0 -1 8 {} O 0.0 {0.601496 0.479126 0.562642} O10 2422 0.0 -1 1 {} H 0.0 {0.654272 0.562908 0.568816} H18 2423 0.0 -1 1 {} H 0.0 {0.644325 0.512204 0.603115} H19 2424 0.0 -1 1 {} H 0.0 {0.661085 0.54489 0.559487} H20 2425 0.0 -1 1 {} H 0.0 {0.679751 0.544958 0.572042} H22 2426 0.0 -1 1 {} H 0.0 {0.387385 0.305396 0.397819} H24 2427 0.0 -1 1 {} H 0.0 {0.411298 0.306117 0.400736} H25 2428 0.0 -1 1 {} H 0.0 {0.622133 0.460038 0.583355} H26 2429 0.0 -1 1 {} H 0.0 {0.616188 0.470462 0.595279} H27 2430 0.0 -1 1 {} H 0.0 {0.634004 0.471526 0.590837} H28 2431 0.0 -1 1 {} H 0.0 {0.606303 0.519866 0.554234} H29 2432 0.0 -1 1 {} H 0.0 {0.619363 0.510245 0.551938} H31 2433 0.0 -1 1 {} H 0.0 {0.596539 0.506341 0.587948} H32 2434 0.0 -1 1 {} H 0.0 {0.632608 0.47278 0.558094} H33 2435 0.0 -1 1 {} H 0.0 {0.602023 0.487455 0.557329} H34 2436 0.0 -1 7 {} N 0.0 {0.327034 0.369065 0.45702} N3 2437 0.0 -1 1 {} H 0.0 {0.334509 0.374982 0.459457} H16 2438 0.0 -1 1 {} H 0.0 {0.653052 0.536584 0.589594} H17 2439 0.0 -1 7 {} N 0.0 {0.400706 0.316597 0.379591} N6 2440 0.0 -1 1 {} H 0.0 {0.391889 0.313291 0.376902} H41 2441 0.0 -1 1 {} H 0.0 {0.406997 0.31071 0.374383} H42 2442 0.0 -1 14 {} Si 0.0 {0.275894 0.539567 0.566248} Si6 2443 0.0 -1 8 {} O 0.0 {0.271163 0.555203 0.567436} O6 2444 0.0 -1 14 {} Si 0.0 {0.260676 0.567235 0.565675} Si7 2445 0.0 -1 8 {} O 0.0 {0.26439 0.574647 0.551803} O7 2446 0.0 -1 14 {} Si 0.0 {0.265007 0.589007 0.54462} Si8 2447 0.0 -1 7 {} N 0.0 {0.250093 0.599515 0.537575} N2 2448 0.0 -1 14 {} Si 0.0 {0.249557 0.60574 0.52273} Si9 2449 0.0 -1 14 {} Si 0.0 {0.24705 0.617393 0.54445} Si10 2450 0.0 -1 6 {} C 0.0 {0.291649 0.53292 0.570434} C3 2451 0.0 -1 7 {} N 0.0 {0.256272 0.580954 0.58147} N 2452 0.0 -1 8 {} O 0.0 {0.29099 0.598955 0.540569} O8 2453 0.0 -1 8 {} O 0.0 {0.271777 0.54272 0.545277} O9 2454 0.0 -1 8 {} O 0.0 {0.261511 0.533165 0.570566} O10 2455 0.0 -1 1 {} H 0.0 {0.30011 0.595342 0.539836} H18 2456 0.0 -1 1 {} H 0.0 {0.276632 0.590022 0.534513} H19 2457 0.0 -1 1 {} H 0.0 {0.683945 0.590647 0.31082} H20 2458 0.0 -1 1 {} H 0.0 {0.26478 0.607441 0.515487} H22 2459 0.0 -1 1 {} H 0.0 {0.234863 0.620658 0.541198} H24 2460 0.0 -1 1 {} H 0.0 {0.257447 0.630988 0.540788} H25 2461 0.0 -1 1 {} H 0.0 {0.290009 0.523464 0.574596} H26 2462 0.0 -1 1 {} H 0.0 {0.296485 0.54007 0.576907} H27 2463 0.0 -1 1 {} H 0.0 {0.297629 0.536396 0.554791} H28 2464 0.0 -1 1 {} H 0.0 {0.264197 0.576952 0.587459} H29 2465 0.0 -1 1 {} H 0.0 {0.261673 0.588123 0.576733} H31 2466 0.0 -1 1 {} H 0.0 {0.267728 0.503692 0.649159} H32 2467 0.0 -1 1 {} H 0.0 {0.270717 0.552742 0.54606} H33 2468 0.0 -1 1 {} H 0.0 {0.258843 0.526067 0.56426} H34 2469 0.0 -1 7 {} N 0.0 {0.616068 0.633537 0.503699} N3 2470 0.0 -1 1 {} H 0.0 {0.608881 0.631793 0.510429} H16 2471 0.0 -1 1 {} H 0.0 {0.611928 0.640633 0.497579} H17 2472 0.0 -1 7 {} N 0.0 {0.245728 0.614358 0.562217} N6 2473 0.0 -1 1 {} H 0.0 {0.243214 0.604281 0.562218} H41 2474 0.0 -1 1 {} H 0.0 {0.255231 0.61544 0.565679} H42 2475 0.0 -1 14 {} Si 0.0 {0.312879 0.617695 0.432124} Si6 2476 0.0 -1 8 {} O 0.0 {0.328094 0.617852 0.427666} O6 2477 0.0 -1 14 {} Si 0.0 {0.340515 0.621072 0.418344} Si7 2478 0.0 -1 8 {} O 0.0 {0.332033 0.614531 0.406091} O7 2479 0.0 -1 14 {} Si 0.0 {0.328276 0.600334 0.40099} Si8 2480 0.0 -1 7 {} N 0.0 {0.334296 0.583181 0.408725} N2 2481 0.0 -1 14 {} Si 0.0 {0.341301 0.569233 0.404141} Si9 2482 0.0 -1 14 {} Si 0.0 {0.33562 0.585904 0.424142} Si10 2483 0.0 -1 6 {} C 0.0 {0.299917 0.622717 0.420503} C3 2484 0.0 -1 7 {} N 0.0 {0.36123 0.643297 0.425667} N 2485 0.0 -1 8 {} O 0.0 {0.350645 0.608784 0.422054} O8 2486 0.0 -1 8 {} O 0.0 {0.315172 0.62199 0.447035} O9 2487 0.0 -1 8 {} O 0.0 {0.312834 0.597625 0.439651} O10 2488 0.0 -1 1 {} H 0.0 {0.313036 0.599634 0.401317} H18 2489 0.0 -1 1 {} H 0.0 {0.331643 0.601104 0.385718} H19 2490 0.0 -1 1 {} H 0.0 {0.351354 0.560741 0.413243} H20 2491 0.0 -1 1 {} H 0.0 {0.328908 0.559287 0.404132} H22 2492 0.0 -1 1 {} H 0.0 {0.322086 0.593412 0.433246} H24 2493 0.0 -1 1 {} H 0.0 {0.344541 0.600147 0.421698} H25 2494 0.0 -1 1 {} H 0.0 {0.295831 0.613701 0.415675} H26 2495 0.0 -1 1 {} H 0.0 {0.303158 0.631031 0.41384} H27 2496 0.0 -1 1 {} H 0.0 {0.292067 0.626576 0.427585} H28 2497 0.0 -1 1 {} H 0.0 {0.36938 0.637347 0.426009} H29 2498 0.0 -1 1 {} H 0.0 {0.364841 0.652482 0.422435} H31 2499 0.0 -1 1 {} H 0.0 {0.356363 0.60769 0.40788} H32 2500 0.0 -1 1 {} H 0.0 {0.322455 0.62864 0.447229} H33 2501 0.0 -1 1 {} H 0.0 {0.316879 0.597915 0.448851} H34 2502 0.0 -1 7 {} N 0.0 {0.349409 0.5724 0.387292} N3 2503 0.0 -1 1 {} H 0.0 {0.351329 0.562791 0.385045} H16 2504 0.0 -1 1 {} H 0.0 {0.341953 0.575631 0.382066} H17 2505 0.0 -1 7 {} N 0.0 {0.35218 0.579376 0.434022} N6 2506 0.0 -1 1 {} H 0.0 {0.35032 0.579074 0.444017} H41 2507 0.0 -1 1 {} H 0.0 {0.358305 0.587091 0.432858} H42 2508 0.0 -1 14 {} Si 0.0 {0.392435 0.373226 0.544854} Si6 2509 0.0 -1 8 {} O 0.0 {0.399086 0.386334 0.550042} O6 2510 0.0 -1 14 {} Si 0.0 {0.405456 0.395206 0.561414} Si7 2511 0.0 -1 8 {} O 0.0 {0.419558 0.390311 0.559342} O7 2512 0.0 -1 14 {} Si 0.0 {0.43093 0.378307 0.558061} Si8 2513 0.0 -1 7 {} N 0.0 {0.448727 0.384028 0.551118} N2 2514 0.0 -1 14 {} Si 0.0 {0.449269 0.397412 0.560274} Si9 2515 0.0 -1 14 {} Si 0.0 {0.455563 0.386898 0.536116} Si10 2516 0.0 -1 6 {} C 0.0 {0.380807 0.363483 0.555899} C3 2517 0.0 -1 7 {} N 0.0 {0.402749 0.415177 0.562939} N 2518 0.0 -1 8 {} O 0.0 {0.401032 0.388115 0.575099} O8 2519 0.0 -1 8 {} O 0.0 {0.411192 0.36504 0.538619} O9 2520 0.0 -1 8 {} O 0.0 {0.387607 0.379049 0.530336} O10 2521 0.0 -1 1 {} H 0.0 {0.429963 0.37218 0.571808} H18 2522 0.0 -1 1 {} H 0.0 {0.419861 0.370451 0.545142} H19 2523 0.0 -1 1 {} H 0.0 {0.47431 0.357951 0.62772} H20 2524 0.0 -1 1 {} H 0.0 {0.4416 0.411315 0.556927} H22 2525 0.0 -1 1 {} H 0.0 {0.468249 0.391603 0.535322} H24 2526 0.0 -1 1 {} H 0.0 {0.446847 0.392191 0.522817} H25 2527 0.0 -1 1 {} H 0.0 {0.379125 0.35479 0.55046} H26 2528 0.0 -1 1 {} H 0.0 {0.372162 0.369494 0.557744} H27 2529 0.0 -1 1 {} H 0.0 {0.384709 0.361504 0.565699} H28 2530 0.0 -1 1 {} H 0.0 {0.410206 0.418532 0.56923} H29 2531 0.0 -1 1 {} H 0.0 {0.394333 0.41617 0.568563} H31 2532 0.0 -1 1 {} H 0.0 {0.405303 0.379173 0.575672} H32 2533 0.0 -1 1 {} H 0.0 {0.314712 0.350683 0.557232} H33 2534 0.0 -1 1 {} H 0.0 {0.3841 0.387834 0.533003} H34 2535 0.0 -1 7 {} N 0.0 {0.463998 0.400347 0.571226} N3 2536 0.0 -1 1 {} H 0.0 {0.462103 0.394508 0.579371} H16 2537 0.0 -1 1 {} H 0.0 {0.464034 0.409614 0.575694} H17 2538 0.0 -1 7 {} N 0.0 {0.458873 0.369893 0.530737} N6 2539 0.0 -1 1 {} H 0.0 {0.46157 0.363986 0.538164} H41 2540 0.0 -1 1 {} H 0.0 {0.467388 0.371727 0.526003} H42 2541 0.0 -1 14 {} Si 0.0 {0.275861 0.488023 0.322501} Si6 2542 0.0 -1 8 {} O 0.0 {0.659624 0.607971 0.539239} O6 2543 0.0 -1 14 {} Si 0.0 {0.652495 0.598059 0.549572} Si7 2544 0.0 -1 8 {} O 0.0 {0.654798 0.585049 0.541321} O7 2545 0.0 -1 14 {} Si 0.0 {0.65542 0.575147 0.529429} Si8 2546 0.0 -1 7 {} N 0.0 {0.644788 0.575227 0.517562} N2 2547 0.0 -1 14 {} Si 0.0 {0.33176 0.385553 0.384708} Si9 2548 0.0 -1 14 {} Si 0.0 {0.630805 0.579734 0.524647} Si10 2549 0.0 -1 6 {} C 0.0 {0.259565 0.492676 0.318238} C3 2550 0.0 -1 7 {} N 0.0 {0.659987 0.600855 0.567193} N 2551 0.0 -1 8 {} O 0.0 {0.636442 0.598948 0.548394} O8 2552 0.0 -1 8 {} O 0.0 {0.279651 0.474138 0.330625} O9 2553 0.0 -1 8 {} O 0.0 {0.29299 0.490011 0.310971} O10 2554 0.0 -1 1 {} H 0.0 {0.896007 0.455211 0.552849} H18 2555 0.0 -1 1 {} H 0.0 {0.656067 0.560553 0.536982} H19 2556 0.0 -1 1 {} H 0.0 {0.340178 0.38284 0.394818} H20 2557 0.0 -1 1 {} H 0.0 {0.346864 0.372563 0.371238} H22 2558 0.0 -1 1 {} H 0.0 {0.631068 0.592234 0.514597} H24 2559 0.0 -1 1 {} H 0.0 {0.632039 0.587215 0.537898} H25 2560 0.0 -1 1 {} H 0.0 {0.255371 0.485672 0.311832} H26 2561 0.0 -1 1 {} H 0.0 {0.260278 0.503069 0.313947} H27 2562 0.0 -1 1 {} H 0.0 {0.729489 0.577684 0.428346} H28 2563 0.0 -1 1 {} H 0.0 {0.657829 0.591707 0.57202} H29 2564 0.0 -1 1 {} H 0.0 {0.66957 0.601508 0.565204} H31 2565 0.0 -1 1 {} H 0.0 {0.634416 0.607294 0.542989} H32 2566 0.0 -1 1 {} H 0.0 {0.286912 0.469787 0.324984} H33 2567 0.0 -1 1 {} H 0.0 {0.277163 0.503863 0.349836} H34 2568 0.0 -1 7 {} N 0.0 {0.315191 0.384318 0.390345} N3 2569 0.0 -1 1 {} H 0.0 {0.309543 0.391562 0.385675} H16 2570 0.0 -1 1 {} H 0.0 {0.386723 0.244887 0.570118} H17 2571 0.0 -1 7 {} N 0.0 {0.61923 0.565675 0.520473} N6 2572 0.0 -1 1 {} H 0.0 {0.621927 0.562923 0.510804} H41 2573 0.0 -1 1 {} H 0.0 {0.622636 0.557538 0.525461} H42 2574 0.0 -1 14 {} Si 0.0 {0.655127 0.517975 0.396797} Si6 2575 0.0 -1 8 {} O 0.0 {0.689104 0.580891 0.336399} O6 2576 0.0 -1 14 {} Si 0.0 {0.700449 0.607998 0.339571} Si7 2577 0.0 -1 8 {} O 0.0 {0.453936 0.64699 0.662597} O7 2578 0.0 -1 14 {} Si 0.0 {0.468239 0.622349 0.67709} Si8 2579 0.0 -1 7 {} N 0.0 {0.486 0.655975 0.690266} N2 2580 0.0 -1 14 {} Si 0.0 {0.470545 0.659976 0.686292} Si9 2581 0.0 -1 14 {} Si 0.0 {0.484706 0.643796 0.675011} Si10 2582 0.0 -1 6 {} C 0.0 {0.685306 0.501323 0.355581} C3 2583 0.0 -1 7 {} N 0.0 {0.706306 0.605855 0.323812} N 2584 0.0 -1 8 {} O 0.0 {0.707619 0.609923 0.353683} O8 2585 0.0 -1 8 {} O 0.0 {0.623015 0.541875 0.383699} O9 2586 0.0 -1 8 {} O 0.0 {0.656333 0.501313 0.394284} O10 2587 0.0 -1 1 {} H 0.0 {0.453074 0.629538 0.682232} H18 2588 0.0 -1 1 {} H 0.0 {0.447977 0.596849 0.669235} H19 2589 0.0 -1 1 {} H 0.0 {0.461663 0.652516 0.699004} H20 2590 0.0 -1 1 {} H 0.0 {0.492303 0.663241 0.686409} H22 2591 0.0 -1 1 {} H 0.0 {0.483026 0.648148 0.659612} H24 2592 0.0 -1 1 {} H 0.0 {0.476377 0.632483 0.676419} H25 2593 0.0 -1 1 {} H 0.0 {0.633065 0.529023 0.408676} H26 2594 0.0 -1 1 {} H 0.0 {0.687146 0.49758 0.346142} H27 2595 0.0 -1 1 {} H 0.0 {0.686813 0.511646 0.356522} H28 2596 0.0 -1 1 {} H 0.0 {0.71588 0.60642 0.320967} H29 2597 0.0 -1 1 {} H 0.0 {0.703619 0.595805 0.320391} H31 2598 0.0 -1 1 {} H 0.0 {0.43231 0.518114 0.284974} H32 2599 0.0 -1 1 {} H 0.0 {0.666162 0.520202 0.407715} H33 2600 0.0 -1 1 {} H 0.0 {0.656023 0.497461 0.404802} H34 2601 0.0 -1 7 {} N 0.0 {0.467981 0.678505 0.681347} N3 2602 0.0 -1 1 {} H 0.0 {0.470399 0.682595 0.690179} H16 2603 0.0 -1 1 {} H 0.0 {0.458018 0.677941 0.681548} H17 2604 0.0 -1 7 {} N 0.0 {0.50235 0.635909 0.673922} N6 2605 0.0 -1 1 {} H 0.0 {0.498773 0.626557 0.670697} H41 2606 0.0 -1 1 {} H 0.0 {0.507 0.640333 0.666195} H42 2607 0.0 -1 14 {} Si 0.0 {0.310784 0.529055 0.595142} Si6 2608 0.0 -1 8 {} O 0.0 {0.30061 0.52116 0.602897} O6 2609 0.0 -1 14 {} Si 0.0 {0.293525 0.519156 0.616968} Si7 2610 0.0 -1 8 {} O 0.0 {0.279805 0.523841 0.612974} O7 2611 0.0 -1 14 {} Si 0.0 {0.265178 0.525226 0.606701} Si8 2612 0.0 -1 7 {} N 0.0 {0.257307 0.511595 0.595621} N2 2613 0.0 -1 14 {} Si 0.0 {0.244518 0.50529 0.58739} Si9 2614 0.0 -1 14 {} Si 0.0 {0.27184 0.504645 0.592459} Si10 2615 0.0 -1 6 {} C 0.0 {0.324943 0.521427 0.588374} C3 2616 0.0 -1 7 {} N 0.0 {0.297222 0.50372 0.624235} N 2617 0.0 -1 8 {} O 0.0 {0.296303 0.533796 0.632479} O8 2618 0.0 -1 8 {} O 0.0 {0.306624 0.543985 0.597095} O9 2619 0.0 -1 8 {} O 0.0 {0.256983 0.577194 0.652573} O10 2620 0.0 -1 1 {} H 0.0 {0.257333 0.567812 0.646161} H18 2621 0.0 -1 1 {} H 0.0 {0.266075 0.537925 0.59734} H19 2622 0.0 -1 1 {} H 0.0 {0.233169 0.515879 0.592865} H20 2623 0.0 -1 1 {} H 0.0 {0.24413 0.509665 0.572308} H22 2624 0.0 -1 1 {} H 0.0 {0.281877 0.514943 0.594722} H24 2625 0.0 -1 1 {} H 0.0 {0.273697 0.503916 0.575927} H25 2626 0.0 -1 1 {} H 0.0 {0.331476 0.529026 0.584427} H26 2627 0.0 -1 1 {} H 0.0 {0.314314 0.516391 0.559067} H27 2628 0.0 -1 1 {} H 0.0 {0.328525 0.515585 0.596801} H28 2629 0.0 -1 1 {} H 0.0 {0.292519 0.500818 0.633248} H29 2630 0.0 -1 1 {} H 0.0 {0.293454 0.49755 0.617546} H31 2631 0.0 -1 1 {} H 0.0 {0.28676 0.536027 0.634817} H32 2632 0.0 -1 1 {} H 0.0 {0.313313 0.547771 0.603091} H33 2633 0.0 -1 1 {} H 0.0 {0.259728 0.584755 0.647153} H34 2634 0.0 -1 7 {} N 0.0 {0.237564 0.487408 0.590145} N3 2635 0.0 -1 1 {} H 0.0 {0.231342 0.488909 0.597464} H16 2636 0.0 -1 1 {} H 0.0 {0.244868 0.481185 0.594458} H17 2637 0.0 -1 7 {} N 0.0 {0.276052 0.489509 0.603347} N6 2638 0.0 -1 1 {} H 0.0 {0.279004 0.481716 0.597248} H41 2639 0.0 -1 1 {} H 0.0 {0.266575 0.487835 0.606838} H42 2640 0.0 -1 14 {} Si 0.0 {0.450232 0.419716 0.376531} Si6 2641 0.0 -1 8 {} O 0.0 {0.435967 0.426036 0.376858} O6 2642 0.0 -1 14 {} Si 0.0 {0.421954 0.428772 0.384652} Si7 2643 0.0 -1 8 {} O 0.0 {0.426029 0.443453 0.388394} O7 2644 0.0 -1 14 {} Si 0.0 {0.43103 0.458544 0.3868} Si8 2645 0.0 -1 7 {} N 0.0 {0.444848 0.466045 0.399265} N2 2646 0.0 -1 14 {} Si 0.0 {0.44331 0.476573 0.411344} Si9 2647 0.0 -1 14 {} Si 0.0 {0.455297 0.4545 0.402399} Si10 2648 0.0 -1 6 {} C 0.0 {0.45551 0.40542 0.38796} C3 2649 0.0 -1 7 {} N 0.0 {0.405605 0.426749 0.373405} N 2650 0.0 -1 8 {} O 0.0 {0.426089 0.421923 0.397614} O8 2651 0.0 -1 8 {} O 0.0 {0.461927 0.436841 0.3779} O9 2652 0.0 -1 8 {} O 0.0 {0.450653 0.419884 0.360967} O10 2653 0.0 -1 1 {} H 0.0 {0.434842 0.462205 0.374793} H18 2654 0.0 -1 1 {} H 0.0 {0.420414 0.466717 0.388662} H19 2655 0.0 -1 1 {} H 0.0 {0.456368 0.474544 0.424627} H20 2656 0.0 -1 1 {} H 0.0 {0.431314 0.490657 0.409839} H22 2657 0.0 -1 1 {} H 0.0 {0.45983 0.44332 0.38865} H24 2658 0.0 -1 1 {} H 0.0 {0.449025 0.442468 0.412417} H25 2659 0.0 -1 1 {} H 0.0 {0.466004 0.402973 0.386155} H26 2660 0.0 -1 1 {} H 0.0 {0.449741 0.396154 0.386527} H27 2661 0.0 -1 1 {} H 0.0 {0.456813 0.408997 0.397493} H28 2662 0.0 -1 1 {} H 0.0 {0.399859 0.432223 0.379931} H29 2663 0.0 -1 1 {} H 0.0 {0.40401 0.417461 0.376406} H31 2664 0.0 -1 1 {} H 0.0 {0.431214 0.427964 0.403849} H32 2665 0.0 -1 1 {} H 0.0 {0.458094 0.442237 0.369937} H33 2666 0.0 -1 1 {} H 0.0 {0.448363 0.411281 0.358259} H34 2667 0.0 -1 7 {} N 0.0 {0.432298 0.469443 0.42584} N3 2668 0.0 -1 1 {} H 0.0 {0.439749 0.465098 0.431872} H16 2669 0.0 -1 1 {} H 0.0 {0.427501 0.462339 0.420369} H17 2670 0.0 -1 7 {} N 0.0 {0.474219 0.459421 0.405373} N6 2671 0.0 -1 1 {} H 0.0 {0.479963 0.454672 0.398964} H41 2672 0.0 -1 1 {} H 0.0 {0.472319 0.468563 0.400811} H42 2673 0.0 -1 14 {} Si 0.0 {0.525601 0.554914 0.277823} Si6 2674 0.0 -1 8 {} O 0.0 {0.520269 0.545166 0.289588} O6 2675 0.0 -1 14 {} Si 0.0 {0.513825 0.532345 0.295081} Si7 2676 0.0 -1 8 {} O 0.0 {0.526199 0.522092 0.294904} O7 2677 0.0 -1 14 {} Si 0.0 {0.537882 0.514584 0.28692} Si8 2678 0.0 -1 7 {} N 0.0 {0.55207 0.513747 0.295391} N2 2679 0.0 -1 14 {} Si 0.0 {0.556672 0.529229 0.289953} Si9 2680 0.0 -1 14 {} Si 0.0 {0.557185 0.504208 0.307799} Si10 2681 0.0 -1 6 {} C 0.0 {0.514386 0.566803 0.271056} C3 2682 0.0 -1 7 {} N 0.0 {0.502905 0.536366 0.31159} N 2683 0.0 -1 8 {} O 0.0 {0.403337 0.56257 0.607902} O8 2684 0.0 -1 8 {} O 0.0 {0.530098 0.542551 0.268965} O9 2685 0.0 -1 8 {} O 0.0 {0.545635 0.562454 0.280901} O10 2686 0.0 -1 1 {} H 0.0 {0.555905 0.393066 0.335415} H18 2687 0.0 -1 1 {} H 0.0 {0.501946 0.529501 0.189914} H19 2688 0.0 -1 1 {} H 0.0 {0.548709 0.556618 0.287544} H20 2689 0.0 -1 1 {} H 0.0 {0.545048 0.526586 0.277241} H22 2690 0.0 -1 1 {} H 0.0 {0.518191 0.500371 0.360482} H24 2691 0.0 -1 1 {} H 0.0 {0.549687 0.50706 0.324649} H25 2692 0.0 -1 1 {} H 0.0 {0.511437 0.574452 0.277939} H26 2693 0.0 -1 1 {} H 0.0 {0.482677 0.564824 0.267388} H27 2694 0.0 -1 1 {} H 0.0 {0.517712 0.571129 0.262004} H28 2695 0.0 -1 1 {} H 0.0 {0.495955 0.529335 0.31086} H29 2696 0.0 -1 1 {} H 0.0 {0.497813 0.544546 0.308973} H31 2697 0.0 -1 1 {} H 0.0 {0.406326 0.567253 0.616185} H32 2698 0.0 -1 1 {} H 0.0 {0.396951 0.556354 0.61227} H33 2699 0.0 -1 1 {} H 0.0 {0.393713 0.704731 0.677445} H34 2700 0.0 -1 7 {} N 0.0 {0.557095 0.543479 0.303613} N3 2701 0.0 -1 1 {} H 0.0 {0.562872 0.550198 0.298366} H16 2702 0.0 -1 1 {} H 0.0 {0.563384 0.5415 0.311723} H17 2703 0.0 -1 7 {} N 0.0 {0.572249 0.493541 0.300903} N6 2704 0.0 -1 1 {} H 0.0 {0.575527 0.500195 0.293488} H41 2705 0.0 -1 1 {} H 0.0 {0.569 0.485967 0.295329} H42 2706 0.0 -1 14 {} Si 0.0 {0.591399 0.686973 0.325893} Si6 2707 0.0 -1 8 {} O 0.0 {0.355753 0.701661 0.6016} O6 2708 0.0 -1 14 {} Si 0.0 {0.39542 0.667244 0.629446} Si7 2709 0.0 -1 8 {} O 0.0 {0.386331 0.655476 0.614399} O7 2710 0.0 -1 14 {} Si 0.0 {0.487452 0.299183 0.745508} Si8 2711 0.0 -1 7 {} N 0.0 {0.477688 0.287318 0.750194} N2 2712 0.0 -1 14 {} Si 0.0 {0.464322 0.283215 0.742969} Si9 2713 0.0 -1 14 {} Si 0.0 {0.444047 0.302436 0.738593} Si10 2714 0.0 -1 6 {} C 0.0 {0.393513 0.685095 0.592854} C3 2715 0.0 -1 7 {} N 0.0 {0.414195 0.665242 0.633252} N 2716 0.0 -1 8 {} O 0.0 {0.394867 0.647243 0.578915} O8 2717 0.0 -1 8 {} O 0.0 {0.59375 0.694155 0.31191} O9 2718 0.0 -1 8 {} O 0.0 {0.372261 0.577052 0.64346} O10 2719 0.0 -1 1 {} H 0.0 {0.496452 0.294968 0.733817} H18 2720 0.0 -1 1 {} H 0.0 {0.371381 0.712623 0.601962} H19 2721 0.0 -1 1 {} H 0.0 {0.323236 0.589652 0.539005} H20 2722 0.0 -1 1 {} H 0.0 {0.529079 0.221599 0.563458} H22 2723 0.0 -1 1 {} H 0.0 {0.444761 0.309396 0.726347} H24 2724 0.0 -1 1 {} H 0.0 {0.453638 0.293156 0.740654} H25 2725 0.0 -1 1 {} H 0.0 {0.403564 0.685773 0.595788} H26 2726 0.0 -1 1 {} H 0.0 {0.416149 0.66312 0.576911} H27 2727 0.0 -1 1 {} H 0.0 {0.391747 0.685334 0.582743} H28 2728 0.0 -1 1 {} H 0.0 {0.753742 0.235467 0.956108} H29 2729 0.0 -1 1 {} H 0.0 {0.417049 0.659665 0.624964} H31 2730 0.0 -1 1 {} H 0.0 {0.403713 0.65183 0.579054} H32 2731 0.0 -1 1 {} H 0.0 {0.603255 0.694364 0.311368} H33 2732 0.0 -1 1 {} H 0.0 {0.36833 0.58186 0.651369} H34 2733 0.0 -1 7 {} N 0.0 {0.260404 0.510953 0.649983} N3 2734 0.0 -1 1 {} H 0.0 {0.262353 0.516825 0.642308} H16 2735 0.0 -1 1 {} H 0.0 {0.251369 0.506442 0.648313} H17 2736 0.0 -1 7 {} N 0.0 {0.460574 0.265034 0.73982} N6 2737 0.0 -1 1 {} H 0.0 {0.469567 0.261349 0.742957} H41 2738 0.0 -1 1 {} H 0.0 {0.455154 0.263696 0.748612} H42 2739 0.0 -1 14 {} Si 0.0 {0.246397 0.438686 0.648945} Si6 2740 0.0 -1 8 {} O 0.0 {0.249636 0.453823 0.652039} O6 2741 0.0 -1 14 {} Si 0.0 {0.247369 0.469001 0.65486} Si7 2742 0.0 -1 8 {} O 0.0 {0.520482 0.448463 0.273224} O7 2743 0.0 -1 14 {} Si 0.0 {0.517625 0.421126 0.290912} Si8 2744 0.0 -1 7 {} N 0.0 {0.505667 0.41611 0.301148} N2 2745 0.0 -1 14 {} Si 0.0 {0.493647 0.405434 0.304717} Si9 2746 0.0 -1 14 {} Si 0.0 {0.507185 0.423835 0.315384} Si10 2747 0.0 -1 6 {} C 0.0 {0.448021 0.513472 0.198179} C3 2748 0.0 -1 7 {} N 0.0 {0.271829 0.456103 0.563375} N 2749 0.0 -1 8 {} O 0.0 {0.25671 0.427764 0.655316} O8 2750 0.0 -1 8 {} O 0.0 {0.235952 0.435616 0.63631} O9 2751 0.0 -1 8 {} O 0.0 {0.459184 0.537306 0.209116} O10 2752 0.0 -1 1 {} H 0.0 {0.256376 0.48964 0.661691} H18 2753 0.0 -1 1 {} H 0.0 {0.532135 0.42494 0.292937} H19 2754 0.0 -1 1 {} H 0.0 {0.497097 0.391506 0.311964} H20 2755 0.0 -1 1 {} H 0.0 {0.482659 0.410116 0.316013} H22 2756 0.0 -1 1 {} H 0.0 {0.558197 0.442325 0.472119} H24 2757 0.0 -1 1 {} H 0.0 {0.262509 0.460439 0.562252} H25 2758 0.0 -1 1 {} H 0.0 {0.438643 0.519039 0.196757} H26 2759 0.0 -1 1 {} H 0.0 {0.457819 0.546433 0.205897} H27 2760 0.0 -1 1 {} H 0.0 {0.448563 0.504171 0.193049} H28 2761 0.0 -1 1 {} H 0.0 {0.27332 0.449213 0.556194} H29 2762 0.0 -1 1 {} H 0.0 {0.279413 0.463958 0.561816} H31 2763 0.0 -1 1 {} H 0.0 {0.26144 0.422406 0.648906} H32 2764 0.0 -1 1 {} H 0.0 {0.242526 0.434021 0.627879} H33 2765 0.0 -1 1 {} H 0.0 {0.507126 0.49176 0.209898} H34 2766 0.0 -1 7 {} N 0.0 {0.479388 0.40321 0.291472} N3 2767 0.0 -1 1 {} H 0.0 {0.477299 0.412056 0.287794} H16 2768 0.0 -1 1 {} H 0.0 {0.47196 0.399582 0.296938} H17 2769 0.0 -1 7 {} N 0.0 {0.249617 0.483992 0.667093} N6 2770 0.0 -1 1 {} H 0.0 {0.498776 0.436011 0.316082} H41 2771 0.0 -1 1 {} H 0.0 {0.545931 0.564849 0.761886} H42 2772 0.0 -1 14 {} Si 0.0 {0.282504 0.373336 0.473765} Si6 2773 0.0 -1 8 {} O 0.0 {0.272975 0.384849 0.468234} O6 2774 0.0 -1 14 {} Si 0.0 {0.270061 0.401756 0.467925} Si7 2775 0.0 -1 8 {} O 0.0 {0.28376 0.403731 0.476017} O7 2776 0.0 -1 14 {} Si 0.0 {0.296803 0.396661 0.481859} Si8 2777 0.0 -1 7 {} N 0.0 {0.315702 0.402286 0.478044} N2 2778 0.0 -1 14 {} Si 0.0 {0.332437 0.40488 0.485257} Si9 2779 0.0 -1 14 {} Si 0.0 {0.312375 0.417292 0.473115} Si10 2780 0.0 -1 6 {} C 0.0 {0.277617 0.361778 0.485464} C3 2781 0.0 -1 7 {} N 0.0 {0.265269 0.40954 0.451383} N 2782 0.0 -1 8 {} O 0.0 {0.26005 0.402493 0.480968} O8 2783 0.0 -1 8 {} O 0.0 {0.278638 0.506916 0.562437} O9 2784 0.0 -1 8 {} O 0.0 {0.293697 0.383233 0.505168} O10 2785 0.0 -1 1 {} H 0.0 {0.29478 0.394811 0.500186} H18 2786 0.0 -1 1 {} H 0.0 {0.295102 0.381561 0.479765} H19 2787 0.0 -1 1 {} H 0.0 {0.329141 0.403073 0.50095} H20 2788 0.0 -1 1 {} H 0.0 {0.347748 0.413655 0.542502} H22 2789 0.0 -1 1 {} H 0.0 {0.294364 0.424169 0.475554} H24 2790 0.0 -1 1 {} H 0.0 {0.313217 0.421979 0.457039} H25 2791 0.0 -1 1 {} H 0.0 {0.272182 0.367568 0.492996} H26 2792 0.0 -1 1 {} H 0.0 {0.291753 0.364875 0.459805} H27 2793 0.0 -1 1 {} H 0.0 {0.272049 0.354147 0.481392} H28 2794 0.0 -1 1 {} H 0.0 {0.264669 0.402493 0.444828} H29 2795 0.0 -1 1 {} H 0.0 {0.25524 0.413152 0.453063} H31 2796 0.0 -1 1 {} H 0.0 {0.262292 0.395451 0.487512} H32 2797 0.0 -1 1 {} H 0.0 {0.270059 0.504854 0.558125} H33 2798 0.0 -1 1 {} H 0.0 {0.302661 0.379166 0.503769} H34 2799 0.0 -1 7 {} N 0.0 {0.342865 0.391993 0.477927} N3 2800 0.0 -1 1 {} H 0.0 {0.336964 0.385776 0.472694} H16 2801 0.0 -1 1 {} H 0.0 {0.31027 0.46749 0.33027} H17 2802 0.0 -1 7 {} N 0.0 {0.308355 0.463677 0.320797} N6 2803 0.0 -1 1 {} H 0.0 {0.317956 0.464423 0.316793} H41 2804 0.0 -1 1 {} H 0.0 {0.304935 0.453908 0.32199} H42 2805 0.0 -1 14 {} Si 0.0 {0.603899 0.63803 0.344095} Si6 2806 0.0 -1 8 {} O 0.0 {0.611808 0.624347 0.346842} O6 2807 0.0 -1 14 {} Si 0.0 {0.613135 0.608781 0.349111} Si7 2808 0.0 -1 8 {} O 0.0 {0.627488 0.610212 0.355481} O7 2809 0.0 -1 14 {} Si 0.0 {0.578517 0.604185 0.419613} Si8 2810 0.0 -1 7 {} N 0.0 {0.633864 0.650767 0.317398} N2 2811 0.0 -1 14 {} Si 0.0 {0.626257 0.637173 0.314404} Si9 2812 0.0 -1 14 {} Si 0.0 {0.596069 0.531784 0.376926} Si10 2813 0.0 -1 6 {} C 0.0 {0.609433 0.654189 0.352314} C3 2814 0.0 -1 7 {} N 0.0 {0.601772 0.594597 0.354582} N 2815 0.0 -1 8 {} O 0.0 {0.616957 0.6052 0.333902} O8 2816 0.0 -1 8 {} O 0.0 {0.585821 0.634142 0.350595} O9 2817 0.0 -1 8 {} O 0.0 {0.599832 0.636899 0.329224} O10 2818 0.0 -1 1 {} H 0.0 {0.561359 0.599323 0.429915} H18 2819 0.0 -1 1 {} H 0.0 {0.578766 0.581772 0.428027} H19 2820 0.0 -1 1 {} H 0.0 {0.634609 0.609721 0.349074} H20 2821 0.0 -1 1 {} H 0.0 {0.646337 0.670141 0.343546} H22 2822 0.0 -1 1 {} H 0.0 {0.609684 0.539202 0.381887} H24 2823 0.0 -1 1 {} H 0.0 {0.582186 0.535611 0.382646} H25 2824 0.0 -1 1 {} H 0.0 {0.599902 0.659127 0.354037} H26 2825 0.0 -1 1 {} H 0.0 {0.617204 0.658666 0.346875} H27 2826 0.0 -1 1 {} H 0.0 {0.61347 0.652284 0.361828} H28 2827 0.0 -1 1 {} H 0.0 {0.604783 0.587677 0.347833} H29 2828 0.0 -1 1 {} H 0.0 {0.605949 0.591596 0.363242} H31 2829 0.0 -1 1 {} H 0.0 {0.627108 0.603494 0.334263} H32 2830 0.0 -1 1 {} H 0.0 {0.588403 0.627624 0.357296} H33 2831 0.0 -1 1 {} H 0.0 {0.611003 0.637141 0.323257} H34 2832 0.0 -1 7 {} N 0.0 {0.63743 0.624286 0.32443} N3 2833 0.0 -1 1 {} H 0.0 {0.629226 0.61852 0.328903} H16 2834 0.0 -1 1 {} H 0.0 {0.641074 0.6315 0.331336} H17 2835 0.0 -1 7 {} N 0.0 {0.5993 0.537301 0.359848} N6 2836 0.0 -1 1 {} H 0.0 {0.591348 0.532928 0.35504} H41 2837 0.0 -1 1 {} H 0.0 {0.595746 0.546918 0.359482} H42 2838 0.0 -1 14 {} Si 0.0 {0.36783 0.419241 0.307614} Si6 2839 0.0 -1 8 {} O 0.0 {0.365399 0.402516 0.255838} O6 2840 0.0 -1 14 {} Si 0.0 {0.360168 0.395364 0.26891} Si7 2841 0.0 -1 8 {} O 0.0 {0.366047 0.40508 0.279743} O7 2842 0.0 -1 14 {} Si 0.0 {0.222775 0.469289 0.655255} Si8 2843 0.0 -1 7 {} N 0.0 {0.218075 0.466287 0.640008} N2 2844 0.0 -1 14 {} Si 0.0 {0.208077 0.479111 0.636705} Si9 2845 0.0 -1 14 {} Si 0.0 {0.214584 0.456647 0.626774} Si10 2846 0.0 -1 6 {} C 0.0 {0.354237 0.428107 0.311413} C3 2847 0.0 -1 7 {} N 0.0 {0.342604 0.391794 0.270788} N 2848 0.0 -1 8 {} O 0.0 {0.370828 0.384051 0.270271} O8 2849 0.0 -1 8 {} O 0.0 {0.382669 0.422009 0.310532} O9 2850 0.0 -1 8 {} O 0.0 {0.360059 0.443973 0.306725} O10 2851 0.0 -1 1 {} H 0.0 {0.217947 0.458617 0.664051} H18 2852 0.0 -1 1 {} H 0.0 {0.217516 0.483449 0.666348} H19 2853 0.0 -1 1 {} H 0.0 {0.214332 0.488994 0.630513} H20 2854 0.0 -1 1 {} H 0.0 {0.205964 0.484949 0.65393} H22 2855 0.0 -1 1 {} H 0.0 {0.200471 0.450076 0.626413} H24 2856 0.0 -1 1 {} H 0.0 {0.54948 0.526301 0.749396} H25 2857 0.0 -1 1 {} H 0.0 {0.346506 0.424759 0.305269} H26 2858 0.0 -1 1 {} H 0.0 {0.350305 0.426193 0.321488} H27 2859 0.0 -1 1 {} H 0.0 {0.432869 0.436054 0.256534} H28 2860 0.0 -1 1 {} H 0.0 {0.33684 0.393847 0.262662} H29 2861 0.0 -1 1 {} H 0.0 {0.215877 0.452258 0.58256} H31 2862 0.0 -1 1 {} H 0.0 {0.379023 0.387462 0.273006} H32 2863 0.0 -1 1 {} H 0.0 {0.351689 0.449369 0.306293} H33 2864 0.0 -1 1 {} H 0.0 {0.36382 0.446991 0.315405} H34 2865 0.0 -1 7 {} N 0.0 {0.480429 0.686733 0.379364} N3 2866 0.0 -1 1 {} H 0.0 {0.485953 0.689164 0.371084} H16 2867 0.0 -1 1 {} H 0.0 {0.474905 0.695453 0.381329} H17 2868 0.0 -1 7 {} N 0.0 {0.221505 0.460274 0.608771} N6 2869 0.0 -1 1 {} H 0.0 {0.218445 0.470405 0.609128} H41 2870 0.0 -1 1 {} H 0.0 {0.226436 0.446812 0.632984} H42 2871 0.0 -1 14 {} Si 0.0 {0.387179 0.62698 0.399546} Si6 2872 0.0 -1 8 {} O 0.0 {0.372923 0.622272 0.395159} O6 2873 0.0 -1 14 {} Si 0.0 {0.365737 0.608344 0.394649} Si7 2874 0.0 -1 8 {} O 0.0 {0.543314 0.288077 0.536575} O7 2875 0.0 -1 14 {} Si 0.0 {0.549853 0.273997 0.531629} Si8 2876 0.0 -1 7 {} N 0.0 {0.56268 0.26979 0.541625} N2 2877 0.0 -1 14 {} Si 0.0 {0.568958 0.257218 0.54945} Si9 2878 0.0 -1 14 {} Si 0.0 {0.572985 0.281852 0.547838} Si10 2879 0.0 -1 6 {} C 0.0 {0.403258 0.620467 0.391791} C3 2880 0.0 -1 7 {} N 0.0 {0.356752 0.604653 0.379291} N 2881 0.0 -1 8 {} O 0.0 {0.376218 0.59622 0.396053} O8 2882 0.0 -1 8 {} O 0.0 {0.383826 0.625464 0.414824} O9 2883 0.0 -1 8 {} O 0.0 {0.378327 0.646356 0.397521} O10 2884 0.0 -1 1 {} H 0.0 {0.41692 0.625011 0.324368} H18 2885 0.0 -1 1 {} H 0.0 {0.55309 0.276193 0.516438} H19 2886 0.0 -1 1 {} H 0.0 {0.581213 0.252083 0.539263} H20 2887 0.0 -1 1 {} H 0.0 {0.57108 0.257847 0.56673} H22 2888 0.0 -1 1 {} H 0.0 {0.577398 0.293581 0.53556} H24 2889 0.0 -1 1 {} H 0.0 {0.541069 0.28616 0.547584} H25 2890 0.0 -1 1 {} H 0.0 {0.411244 0.622592 0.398825} H26 2891 0.0 -1 1 {} H 0.0 {0.404789 0.625668 0.382531} H27 2892 0.0 -1 1 {} H 0.0 {0.40097 0.610356 0.391399} H28 2893 0.0 -1 1 {} H 0.0 {0.361901 0.610652 0.372823} H29 2894 0.0 -1 1 {} H 0.0 {0.35858 0.595155 0.376682} H31 2895 0.0 -1 1 {} H 0.0 {0.374089 0.588798 0.389569} H32 2896 0.0 -1 1 {} H 0.0 {0.37449 0.626524 0.41677} H33 2897 0.0 -1 1 {} H 0.0 {0.371458 0.645178 0.404799} H34 2898 0.0 -1 7 {} N 0.0 {0.555991 0.243709 0.545071} N3 2899 0.0 -1 1 {} H 0.0 {0.550135 0.248271 0.53825} H16 2900 0.0 -1 1 {} H 0.0 {0.55014 0.242473 0.553471} H17 2901 0.0 -1 7 {} N 0.0 {0.68197 0.305347 0.630405} N6 2902 0.0 -1 1 {} H 0.0 {0.68909 0.310239 0.625468} H41 2903 0.0 -1 1 {} H 0.0 {0.674595 0.313093 0.630495} H42 2904 0.0 -1 14 {} Si 0.0 {0.416288 0.475831 0.555859} Si6 2905 0.0 -1 8 {} O 0.0 {0.421594 0.465185 0.566864} O6 2906 0.0 -1 14 {} Si 0.0 {0.431284 0.462845 0.578721} Si7 2907 0.0 -1 8 {} O 0.0 {0.444091 0.458895 0.570351} O7 2908 0.0 -1 14 {} Si 0.0 {0.45795 0.462522 0.564172} Si8 2909 0.0 -1 7 {} N 0.0 {0.463701 0.479905 0.556477} N2 2910 0.0 -1 14 {} Si 0.0 {0.455556 0.491778 0.542676} Si9 2911 0.0 -1 14 {} Si 0.0 {0.479849 0.486316 0.547261} Si10 2912 0.0 -1 6 {} C 0.0 {0.398498 0.473868 0.550238} C3 2913 0.0 -1 7 {} N 0.0 {0.430302 0.471244 0.59559} N 2914 0.0 -1 8 {} O 0.0 {0.448867 0.43128 0.600674} O8 2915 0.0 -1 8 {} O 0.0 {0.428635 0.474082 0.545627} O9 2916 0.0 -1 8 {} O 0.0 {0.423767 0.493207 0.56343} O10 2917 0.0 -1 1 {} H 0.0 {0.469502 0.456559 0.572626} H18 2918 0.0 -1 1 {} H 0.0 {0.45773 0.457654 0.54834} H19 2919 0.0 -1 1 {} H 0.0 {0.457451 0.491244 0.527534} H20 2920 0.0 -1 1 {} H 0.0 {0.441887 0.486284 0.544224} H22 2921 0.0 -1 1 {} H 0.0 {0.486255 0.495387 0.559369} H24 2922 0.0 -1 1 {} H 0.0 {0.484189 0.492763 0.535254} H25 2923 0.0 -1 1 {} H 0.0 {0.391915 0.478377 0.558028} H26 2924 0.0 -1 1 {} H 0.0 {0.397053 0.463757 0.548408} H27 2925 0.0 -1 1 {} H 0.0 {0.39687 0.480123 0.542027} H28 2926 0.0 -1 1 {} H 0.0 {0.438044 0.467395 0.600811} H29 2927 0.0 -1 1 {} H 0.0 {0.432024 0.481082 0.595538} H31 2928 0.0 -1 1 {} H 0.0 {0.44601 0.436866 0.608315} H32 2929 0.0 -1 1 {} H 0.0 {0.434639 0.467593 0.549517} H33 2930 0.0 -1 1 {} H 0.0 {0.431627 0.494544 0.557553} H34 2931 0.0 -1 7 {} N 0.0 {0.449915 0.507928 0.547328} N3 2932 0.0 -1 1 {} H 0.0 {0.456377 0.515682 0.544483} H16 2933 0.0 -1 1 {} H 0.0 {0.441693 0.510779 0.542427} H17 2934 0.0 -1 7 {} N 0.0 {0.487667 0.467651 0.544841} N6 2935 0.0 -1 1 {} H 0.0 {0.480763 0.46265 0.550456} H41 2936 0.0 -1 1 {} H 0.0 {0.483632 0.466427 0.535442} H42 2937 0.0 -1 14 {} Si 0.0 {0.371881 0.537914 0.624194} Si6 2938 0.0 -1 8 {} O 0.0 {0.387992 0.539615 0.625128} O6 2939 0.0 -1 14 {} Si 0.0 {0.392549 0.506589 0.630067} Si7 2940 0.0 -1 8 {} O 0.0 {0.407419 0.502735 0.632794} O7 2941 0.0 -1 14 {} Si 0.0 {0.417879 0.49149 0.629355} Si8 2942 0.0 -1 7 {} N 0.0 {0.430658 0.492112 0.618342} N2 2943 0.0 -1 14 {} Si 0.0 {0.429054 0.50431 0.603013} Si9 2944 0.0 -1 14 {} Si 0.0 {0.447679 0.490561 0.616845} Si10 2945 0.0 -1 6 {} C 0.0 {0.363244 0.524447 0.614223} C3 2946 0.0 -1 7 {} N 0.0 {0.383436 0.51399 0.645057} N 2947 0.0 -1 8 {} O 0.0 {0.390761 0.508441 0.611299} O8 2948 0.0 -1 8 {} O 0.0 {0.369611 0.553789 0.620445} O9 2949 0.0 -1 8 {} O 0.0 {0.368771 0.539184 0.639911} O10 2950 0.0 -1 1 {} H 0.0 {0.425585 0.487018 0.643138} H18 2951 0.0 -1 1 {} H 0.0 {0.409947 0.478873 0.624816} H19 2952 0.0 -1 1 {} H 0.0 {0.429386 0.515634 0.609127} H20 2953 0.0 -1 1 {} H 0.0 {0.440651 0.507224 0.592265} H22 2954 0.0 -1 1 {} H 0.0 {0.45341 0.500503 0.607806} H24 2955 0.0 -1 1 {} H 0.0 {0.451016 0.476334 0.610713} H25 2956 0.0 -1 1 {} H 0.0 {0.359883 0.516336 0.619637} H26 2957 0.0 -1 1 {} H 0.0 {0.369397 0.520944 0.607184} H27 2958 0.0 -1 1 {} H 0.0 {0.354854 0.528194 0.609172} H28 2959 0.0 -1 1 {} H 0.0 {0.379767 0.522604 0.641771} H29 2960 0.0 -1 1 {} H 0.0 {0.390488 0.515716 0.652218} H31 2961 0.0 -1 1 {} H 0.0 {0.397773 0.503014 0.607175} H32 2962 0.0 -1 1 {} H 0.0 {0.370918 0.558825 0.628703} H33 2963 0.0 -1 1 {} H 0.0 {0.298813 0.541714 0.627159} H34 2964 0.0 -1 7 {} N 0.0 {0.413044 0.498536 0.594232} N3 2965 0.0 -1 1 {} H 0.0 {0.412956 0.488369 0.598321} H16 2966 0.0 -1 1 {} H 0.0 {0.417392 0.497352 0.584816} H17 2967 0.0 -1 7 {} N 0.0 {0.456127 0.493659 0.634136} N6 2968 0.0 -1 1 {} H 0.0 {0.465539 0.490841 0.631181} H41 2969 0.0 -1 1 {} H 0.0 {0.457038 0.50381 0.634839} H42 2970 0.0 -1 14 {} Si 0.0 {0.633453 0.485653 0.521968} Si6 2971 0.0 -1 8 {} O 0.0 {0.644573 0.475801 0.527296} O6 2972 0.0 -1 14 {} Si 0.0 {0.646434 0.46284 0.535758} Si7 2973 0.0 -1 8 {} O 0.0 {0.661029 0.459095 0.531498} O7 2974 0.0 -1 14 {} Si 0.0 {0.66975 0.458508 0.518532} Si8 2975 0.0 -1 7 {} N 0.0 {0.674648 0.441013 0.512571} N2 2976 0.0 -1 14 {} Si 0.0 {0.661001 0.432911 0.509738} Si9 2977 0.0 -1 14 {} Si 0.0 {0.686377 0.43488 0.502661} Si10 2978 0.0 -1 6 {} C 0.0 {0.617042 0.479932 0.515903} C3 2979 0.0 -1 7 {} N 0.0 {0.642473 0.456519 0.553291} N 2980 0.0 -1 8 {} O 0.0 {0.638528 0.449542 0.522276} O8 2981 0.0 -1 8 {} O 0.0 {0.646378 0.496661 0.50866} O9 2982 0.0 -1 8 {} O 0.0 {0.635039 0.49634 0.535218} O10 2983 0.0 -1 1 {} H 0.0 {0.66024 0.464114 0.50636} H18 2984 0.0 -1 1 {} H 0.0 {0.682207 0.467606 0.522758} H19 2985 0.0 -1 1 {} H 0.0 {0.65415 0.435098 0.495901} H20 2986 0.0 -1 1 {} H 0.0 {0.648495 0.443722 0.518257} H22 2987 0.0 -1 1 {} H 0.0 {0.686003 0.445343 0.48959} H24 2988 0.0 -1 1 {} H 0.0 {0.6844 0.420294 0.501058} H25 2989 0.0 -1 1 {} H 0.0 {0.612382 0.487664 0.510587} H26 2990 0.0 -1 1 {} H 0.0 {0.611197 0.476973 0.524183} H27 2991 0.0 -1 1 {} H 0.0 {0.61994 0.471822 0.509364} H28 2992 0.0 -1 1 {} H 0.0 {0.636779 0.44891 0.551934} H29 2993 0.0 -1 1 {} H 0.0 {0.651607 0.453587 0.556816} H31 2994 0.0 -1 1 {} H 0.0 {0.633886 0.442383 0.527298} H32 2995 0.0 -1 1 {} H 0.0 {0.644357 0.506975 0.511658} H33 2996 0.0 -1 1 {} H 0.0 {0.633453 0.491379 0.54318} H34 2997 0.0 -1 7 {} N 0.0 {0.659871 0.413963 0.516505} N3 2998 0.0 -1 1 {} H 0.0 {0.668614 0.414471 0.52257} H16 2999 0.0 -1 1 {} H 0.0 {0.652368 0.413661 0.523287} H17 3000 0.0 -1 7 {} N 0.0 {0.702846 0.440594 0.513073} N6 3001 0.0 -1 1 {} H 0.0 {0.704507 0.433764 0.520708} H41 3002 0.0 -1 1 {} H 0.0 {0.699256 0.448848 0.518229} H42 3003 0.0 -1 14 {} Si 0.0 {0.673901 0.630191 0.383904} Si6 3004 0.0 -1 8 {} O 0.0 {0.633981 0.653314 0.407037} O6 3005 0.0 -1 14 {} Si 0.0 {0.651929 0.649261 0.394495} Si7 3006 0.0 -1 8 {} O 0.0 {0.662258 0.641621 0.384874} O7 3007 0.0 -1 14 {} Si 0.0 {0.660316 0.674174 0.392594} Si8 3008 0.0 -1 7 {} N 0.0 {0.648571 0.689648 0.39409} N2 3009 0.0 -1 14 {} Si 0.0 {0.648568 0.684153 0.409503} Si9 3010 0.0 -1 14 {} Si 0.0 {0.757401 0.411056 0.489214} Si10 3011 0.0 -1 6 {} C 0.0 {0.689221 0.634782 0.378907} C3 3012 0.0 -1 7 {} N 0.0 {0.495465 0.221228 0.552622} N 3013 0.0 -1 8 {} O 0.0 {0.616728 0.701024 0.499055} O8 3014 0.0 -1 8 {} O 0.0 {0.453675 0.646557 0.705488} O9 3015 0.0 -1 8 {} O 0.0 {0.671321 0.620979 0.402454} O10 3016 0.0 -1 1 {} H 0.0 {0.673234 0.673933 0.39866} H18 3017 0.0 -1 1 {} H 0.0 {0.656094 0.661689 0.393515} H19 3018 0.0 -1 1 {} H 0.0 {0.656355 0.692176 0.41782} H20 3019 0.0 -1 1 {} H 0.0 {0.633876 0.684757 0.414726} H22 3020 0.0 -1 1 {} H 0.0 {0.754516 0.397116 0.493833} H24 3021 0.0 -1 1 {} H 0.0 {0.726286 0.39908 0.437009} H25 3022 0.0 -1 1 {} H 0.0 {0.452507 0.689447 0.66325} H26 3023 0.0 -1 1 {} H 0.0 {0.692968 0.64196 0.385373} H27 3024 0.0 -1 1 {} H 0.0 {0.69014 0.637614 0.368536} H28 3025 0.0 -1 1 {} H 0.0 {0.492837 0.226259 0.54393} H29 3026 0.0 -1 1 {} H 0.0 {0.505306 0.221572 0.554447} H31 3027 0.0 -1 1 {} H 0.0 {0.607836 0.715008 0.516305} H32 3028 0.0 -1 1 {} H 0.0 {0.450338 0.640142 0.698206} H33 3029 0.0 -1 1 {} H 0.0 {0.675465 0.61243 0.398957} H34 3030 0.0 -1 7 {} N 0.0 {0.604464 0.54016 0.726648} N3 3031 0.0 -1 1 {} H 0.0 {0.595361 0.54363 0.723394} H16 3032 0.0 -1 1 {} H 0.0 {0.604409 0.542515 0.736342} H17 3033 0.0 -1 7 {} N 0.0 {0.770207 0.411776 0.47972} N6 3034 0.0 -1 1 {} H 0.0 {0.604306 0.52991 0.72702} H41 3035 0.0 -1 1 {} H 0.0 {0.769133 0.416769 0.470663} H42 3036 0.0 -1 14 {} Si 0.0 {0.491717 0.680565 0.622971} Si6 3037 0.0 -1 8 {} O 0.0 {0.49171 0.666608 0.631538} O6 3038 0.0 -1 14 {} Si 0.0 {0.489181 0.650798 0.632194} Si7 3039 0.0 -1 8 {} O 0.0 {0.479439 0.650042 0.620305} O7 3040 0.0 -1 14 {} Si 0.0 {0.463871 0.65171 0.614428} Si8 3041 0.0 -1 7 {} N 0.0 {0.451997 0.667017 0.613395} N2 3042 0.0 -1 14 {} Si 0.0 {0.473366 0.695606 0.579336} Si9 3043 0.0 -1 14 {} Si 0.0 {0.444958 0.679523 0.605297} Si10 3044 0.0 -1 6 {} C 0.0 {0.479617 0.692224 0.62898} C3 3045 0.0 -1 7 {} N 0.0 {0.504345 0.639521 0.633312} N 3046 0.0 -1 8 {} O 0.0 {0.478275 0.650496 0.644661} O8 3047 0.0 -1 8 {} O 0.0 {0.490412 0.674722 0.607236} O9 3048 0.0 -1 8 {} O 0.0 {0.511566 0.683778 0.626447} O10 3049 0.0 -1 1 {} H 0.0 {0.46621 0.647516 0.598668} H18 3050 0.0 -1 1 {} H 0.0 {0.458905 0.641201 0.62064} H19 3051 0.0 -1 1 {} H 0.0 {0.480205 0.681898 0.580036} H20 3052 0.0 -1 1 {} H 0.0 {0.483524 0.705283 0.578141} H22 3053 0.0 -1 1 {} H 0.0 {0.433601 0.684613 0.616315} H24 3054 0.0 -1 1 {} H 0.0 {0.444853 0.662019 0.619427} H25 3055 0.0 -1 1 {} H 0.0 {0.47169 0.68646 0.633204} H26 3056 0.0 -1 1 {} H 0.0 {0.475975 0.698522 0.615334} H27 3057 0.0 -1 1 {} H 0.0 {0.483553 0.698601 0.636254} H28 3058 0.0 -1 1 {} H 0.0 {0.511688 0.645277 0.63594} H29 3059 0.0 -1 1 {} H 0.0 {0.501759 0.633659 0.641821} H31 3060 0.0 -1 1 {} H 0.0 {0.47189 0.658404 0.643392} H32 3061 0.0 -1 1 {} H 0.0 {0.486282 0.665291 0.608299} H33 3062 0.0 -1 1 {} H 0.0 {0.516546 0.678182 0.619207} H34 3063 0.0 -1 7 {} N 0.0 {0.617558 0.352272 0.388882} N3 3064 0.0 -1 1 {} H 0.0 {0.623407 0.359535 0.393029} H16 3065 0.0 -1 1 {} H 0.0 {0.618671 0.352139 0.378909} H17 3066 0.0 -1 7 {} N 0.0 {0.43861 0.677125 0.588655} N6 3067 0.0 -1 1 {} H 0.0 {0.442826 0.669199 0.584186} H41 3068 0.0 -1 1 {} H 0.0 {0.44168 0.685967 0.584365} H42 3069 0.0 -1 14 {} Si 0.0 {0.417495 0.587054 0.298858} Si6 3070 0.0 -1 8 {} O 0.0 {0.415538 0.600941 0.291402} O6 3071 0.0 -1 14 {} Si 0.0 {0.422424 0.612975 0.283367} Si7 3072 0.0 -1 8 {} O 0.0 {0.424806 0.604964 0.270306} O7 3073 0.0 -1 14 {} Si 0.0 {0.432191 0.593849 0.262405} Si8 3074 0.0 -1 7 {} N 0.0 {0.447497 0.595146 0.254803} N2 3075 0.0 -1 14 {} Si 0.0 {0.452745 0.61076 0.260314} Si9 3076 0.0 -1 14 {} Si 0.0 {0.455091 0.593509 0.240559} Si10 3077 0.0 -1 6 {} C 0.0 {0.408163 0.571218 0.294237} C3 3078 0.0 -1 7 {} N 0.0 {0.418395 0.629819 0.280161} N 3079 0.0 -1 8 {} O 0.0 {0.442684 0.613003 0.288442} O8 3080 0.0 -1 8 {} O 0.0 {0.413618 0.594158 0.312797} O9 3081 0.0 -1 8 {} O 0.0 {0.436637 0.585907 0.304598} O10 3082 0.0 -1 1 {} H 0.0 {0.430305 0.578268 0.269004} H18 3083 0.0 -1 1 {} H 0.0 {0.424135 0.592585 0.245664} H19 3084 0.0 -1 1 {} H 0.0 {0.446903 0.623334 0.253722} H20 3085 0.0 -1 1 {} H 0.0 {0.44667 0.611442 0.277519} H22 3086 0.0 -1 1 {} H 0.0 {0.453202 0.604138 0.22939} H24 3087 0.0 -1 1 {} H 0.0 {0.444135 0.583439 0.23203} H25 3088 0.0 -1 1 {} H 0.0 {0.409703 0.568238 0.284455} H26 3089 0.0 -1 1 {} H 0.0 {0.397908 0.573101 0.296716} H27 3090 0.0 -1 1 {} H 0.0 {0.411271 0.563755 0.301551} H28 3091 0.0 -1 1 {} H 0.0 {0.412198 0.634276 0.286692} H29 3092 0.0 -1 1 {} H 0.0 {0.427415 0.634915 0.281561} H31 3093 0.0 -1 1 {} H 0.0 {0.444704 0.603244 0.292374} H32 3094 0.0 -1 1 {} H 0.0 {0.420556 0.600335 0.31512} H33 3095 0.0 -1 1 {} H 0.0 {0.441924 0.591785 0.297998} H34 3096 0.0 -1 7 {} N 0.0 {0.470854 0.610601 0.267867} N3 3097 0.0 -1 1 {} H 0.0 {0.470696 0.604068 0.275251} H16 3098 0.0 -1 1 {} H 0.0 {0.475221 0.606447 0.259817} H17 3099 0.0 -1 7 {} N 0.0 {0.473157 0.585627 0.242775} N6 3100 0.0 -1 1 {} H 0.0 {0.475848 0.586065 0.252826} H41 3101 0.0 -1 1 {} H 0.0 {0.471611 0.575707 0.240749} H42 3102 0.0 -1 14 {} Si 0.0 {0.393488 0.556314 0.424827} Si6 3103 0.0 -1 8 {} O 0.0 {0.395981 0.551611 0.439986} O6 3104 0.0 -1 14 {} Si 0.0 {0.396419 0.543965 0.453355} Si7 3105 0.0 -1 8 {} O 0.0 {0.38032 0.543306 0.455858} O7 3106 0.0 -1 14 {} Si 0.0 {0.367217 0.55157 0.458475} Si8 3107 0.0 -1 7 {} N 0.0 {0.339956 0.539105 0.454702} N2 3108 0.0 -1 14 {} Si 0.0 {0.35398 0.531333 0.455141} Si9 3109 0.0 -1 14 {} Si 0.0 {0.330054 0.530347 0.464126} Si10 3110 0.0 -1 6 {} C 0.0 {0.392728 0.546024 0.408192} C3 3111 0.0 -1 7 {} N 0.0 {0.410792 0.550816 0.464938} N 3112 0.0 -1 8 {} O 0.0 {0.466851 0.562236 0.400608} O8 3113 0.0 -1 8 {} O 0.0 {0.38067 0.564367 0.428034} O9 3114 0.0 -1 8 {} O 0.0 {0.360569 0.551889 0.421878} O10 3115 0.0 -1 1 {} H 0.0 {0.371639 0.567492 0.465922} H18 3116 0.0 -1 1 {} H 0.0 {0.365825 0.558545 0.444494} H19 3117 0.0 -1 1 {} H 0.0 {0.358813 0.521847 0.466749} H20 3118 0.0 -1 1 {} H 0.0 {0.379181 0.424341 0.405911} H22 3119 0.0 -1 1 {} H 0.0 {0.338639 0.514801 0.464328} H24 3120 0.0 -1 1 {} H 0.0 {0.331762 0.535932 0.478711} H25 3121 0.0 -1 1 {} H 0.0 {0.400707 0.54722 0.401035} H26 3122 0.0 -1 1 {} H 0.0 {0.38331 0.54627 0.403646} H27 3123 0.0 -1 1 {} H 0.0 {0.394774 0.535895 0.411613} H28 3124 0.0 -1 1 {} H 0.0 {0.410466 0.546462 0.474304} H29 3125 0.0 -1 1 {} H 0.0 {0.41445 0.560344 0.46641} H31 3126 0.0 -1 1 {} H 0.0 {0.474865 0.560939 0.394451} H32 3127 0.0 -1 1 {} H 0.0 {0.404627 0.569137 0.423521} H33 3128 0.0 -1 1 {} H 0.0 {0.356062 0.544385 0.427738} H34 3129 0.0 -1 7 {} N 0.0 {0.356269 0.522493 0.438105} N3 3130 0.0 -1 1 {} H 0.0 {0.352448 0.513189 0.440085} H16 3131 0.0 -1 1 {} H 0.0 {0.348198 0.526959 0.433815} H17 3132 0.0 -1 7 {} N 0.0 {0.313777 0.524081 0.455899} N6 3133 0.0 -1 1 {} H 0.0 {0.3112 0.530847 0.448637} H41 3134 0.0 -1 1 {} H 0.0 {0.307745 0.527363 0.463366} H42 3135 0.0 -1 14 {} Si 0.0 {0.488208 0.536341 0.718078} Si6 3136 0.0 -1 8 {} O 0.0 {0.484433 0.530585 0.703903} O6 3137 0.0 -1 14 {} Si 0.0 {0.482014 0.549843 0.759869} Si7 3138 0.0 -1 8 {} O 0.0 {0.488422 0.534928 0.758151} O7 3139 0.0 -1 14 {} Si 0.0 {0.486343 0.520798 0.750959} Si8 3140 0.0 -1 7 {} N 0.0 {0.522156 0.530604 0.803222} N2 3141 0.0 -1 14 {} Si 0.0 {0.509572 0.533085 0.78677} Si9 3142 0.0 -1 14 {} Si 0.0 {0.50987 0.512862 0.802181} Si10 3143 0.0 -1 6 {} C 0.0 {0.475845 0.548638 0.726986} C3 3144 0.0 -1 7 {} N 0.0 {0.482193 0.558405 0.776876} N 3145 0.0 -1 8 {} O 0.0 {0.467911 0.544661 0.756602} O8 3146 0.0 -1 8 {} O 0.0 {0.443549 0.54931 0.713808} O9 3147 0.0 -1 8 {} O 0.0 {0.497235 0.520223 0.725779} O10 3148 0.0 -1 1 {} H 0.0 {0.470072 0.519158 0.746084} H18 3149 0.0 -1 1 {} H 0.0 {0.530669 0.50037 0.68911} H19 3150 0.0 -1 1 {} H 0.0 {0.544467 0.495948 0.666711} H20 3151 0.0 -1 1 {} H 0.0 {0.493629 0.532552 0.792724} H22 3152 0.0 -1 1 {} H 0.0 {0.508199 0.501841 0.788902} H24 3153 0.0 -1 1 {} H 0.0 {0.496153 0.512955 0.803054} H25 3154 0.0 -1 1 {} H 0.0 {0.457963 0.507682 0.73753} H26 3155 0.0 -1 1 {} H 0.0 {0.466775 0.548383 0.72162} H27 3156 0.0 -1 1 {} H 0.0 {0.474622 0.544938 0.73689} H28 3157 0.0 -1 1 {} H 0.0 {0.476093 0.554611 0.784422} H29 3158 0.0 -1 1 {} H 0.0 {0.47805 0.567136 0.774506} H31 3159 0.0 -1 1 {} H 0.0 {0.46471 0.537676 0.762183} H32 3160 0.0 -1 1 {} H 0.0 {0.435539 0.547674 0.70927} H33 3161 0.0 -1 1 {} H 0.0 {0.493527 0.520048 0.735301} H34 3162 0.0 -1 7 {} N 0.0 {0.514557 0.551684 0.782533} N3 3163 0.0 -1 1 {} H 0.0 {0.505497 0.554624 0.77927} H16 3164 0.0 -1 1 {} H 0.0 {0.515993 0.555233 0.791924} H17 3165 0.0 -1 7 {} N 0.0 {0.519059 0.50091 0.814072} N6 3166 0.0 -1 1 {} H 0.0 {0.528302 0.505745 0.814323} H41 3167 0.0 -1 1 {} H 0.0 {0.513952 0.503465 0.822372} H42 3168 0.0 -1 14 {} Si 0.0 {0.371031 0.315846 0.666554} Si6 3169 0.0 -1 8 {} O 0.0 {0.372982 0.330581 0.672025} O6 3170 0.0 -1 14 {} Si 0.0 {0.379096 0.344506 0.674202} Si7 3171 0.0 -1 8 {} O 0.0 {0.375536 0.345949 0.689077} O7 3172 0.0 -1 14 {} Si 0.0 {0.37389 0.353401 0.703081} Si8 3173 0.0 -1 7 {} N 0.0 {0.356659 0.35312 0.710979} N2 3174 0.0 -1 14 {} Si 0.0 {0.344491 0.357404 0.701037} Si9 3175 0.0 -1 14 {} Si 0.0 {0.347373 0.35234 0.723959} Si10 3176 0.0 -1 6 {} C 0.0 {0.364443 0.311799 0.648941} C3 3177 0.0 -1 7 {} N 0.0 {0.396723 0.34792 0.666037} N 3178 0.0 -1 8 {} O 0.0 {0.370531 0.357926 0.669235} O8 3179 0.0 -1 8 {} O 0.0 {0.358669 0.313089 0.68165} O9 3180 0.0 -1 8 {} O 0.0 {0.384578 0.309266 0.673038} O10 3181 0.0 -1 1 {} H 0.0 {0.384068 0.34705 0.713424} H18 3182 0.0 -1 1 {} H 0.0 {0.380704 0.367447 0.700592} H19 3183 0.0 -1 1 {} H 0.0 {0.589972 0.25809 0.385084} H20 3184 0.0 -1 1 {} H 0.0 {0.344222 0.370472 0.69733} H22 3185 0.0 -1 1 {} H 0.0 {0.341263 0.363348 0.731119} H24 3186 0.0 -1 1 {} H 0.0 {0.20259 0.490827 0.521664} H25 3187 0.0 -1 1 {} H 0.0 {0.371408 0.315779 0.641894} H26 3188 0.0 -1 1 {} H 0.0 {0.355139 0.316529 0.648434} H27 3189 0.0 -1 1 {} H 0.0 {0.363504 0.301476 0.647273} H28 3190 0.0 -1 1 {} H 0.0 {0.394115 0.356213 0.660638} H29 3191 0.0 -1 1 {} H 0.0 {0.396885 0.340176 0.659953} H31 3192 0.0 -1 1 {} H 0.0 {0.360798 0.356112 0.670563} H32 3193 0.0 -1 1 {} H 0.0 {0.362343 0.305314 0.686948} H33 3194 0.0 -1 1 {} H 0.0 {0.389112 0.304666 0.665274} H34 3195 0.0 -1 7 {} N 0.0 {0.340513 0.343681 0.687859} N3 3196 0.0 -1 1 {} H 0.0 {0.333486 0.337434 0.691669} H16 3197 0.0 -1 1 {} H 0.0 {0.349644 0.339586 0.688115} H17 3198 0.0 -1 7 {} N 0.0 {0.202598 0.490755 0.511423} N6 3199 0.0 -1 1 {} H 0.0 {0.339342 0.338932 0.726863} H41 3200 0.0 -1 1 {} H 0.0 {0.212454 0.489041 0.508897} H42 3201 0.0 -1 14 {} Si 0.0 {0.69523 0.391404 0.576139} Si6 3202 0.0 -1 8 {} O 0.0 {0.69075 0.37714 0.570144} O6 3203 0.0 -1 14 {} Si 0.0 {0.693496 0.362353 0.56411} Si7 3204 0.0 -1 8 {} O 0.0 {0.701446 0.356675 0.577281} O7 3205 0.0 -1 14 {} Si 0.0 {0.714669 0.350539 0.583436} Si8 3206 0.0 -1 7 {} N 0.0 {0.731318 0.360498 0.577598} N2 3207 0.0 -1 14 {} Si 0.0 {0.732187 0.376892 0.576017} Si9 3208 0.0 -1 14 {} Si 0.0 {0.746897 0.35684 0.577338} Si10 3209 0.0 -1 6 {} C 0.0 {0.683017 0.404992 0.579677} C3 3210 0.0 -1 7 {} N 0.0 {0.678764 0.352211 0.5576} N 3211 0.0 -1 8 {} O 0.0 {0.706267 0.365706 0.555232} O8 3212 0.0 -1 8 {} O 0.0 {0.708548 0.392673 0.56637} O9 3213 0.0 -1 8 {} O 0.0 {0.706084 0.382943 0.591136} O10 3214 0.0 -1 1 {} H 0.0 {0.711881 0.34658 0.596788} H18 3215 0.0 -1 1 {} H 0.0 {0.715735 0.336843 0.576339} H19 3216 0.0 -1 1 {} H 0.0 {0.731597 0.383651 0.561561} H20 3217 0.0 -1 1 {} H 0.0 {0.717985 0.380917 0.585844} H22 3218 0.0 -1 1 {} H 0.0 {0.754247 0.357649 0.589997} H24 3219 0.0 -1 1 {} H 0.0 {0.754778 0.357853 0.565172} H25 3220 0.0 -1 1 {} H 0.0 {0.686764 0.411091 0.587677} H26 3221 0.0 -1 1 {} H 0.0 {0.674097 0.400878 0.583954} H27 3222 0.0 -1 1 {} H 0.0 {0.680095 0.409365 0.570402} H28 3223 0.0 -1 1 {} H 0.0 {0.682082 0.349136 0.548387} H29 3224 0.0 -1 1 {} H 0.0 {0.680203 0.34407 0.56373} H31 3225 0.0 -1 1 {} H 0.0 {0.714241 0.362926 0.560559} H32 3226 0.0 -1 1 {} H 0.0 {0.708593 0.384196 0.559593} H33 3227 0.0 -1 1 {} H 0.0 {0.702732 0.373711 0.589612} H34 3228 0.0 -1 7 {} N 0.0 {0.746179 0.385884 0.585836} N3 3229 0.0 -1 1 {} H 0.0 {0.743334 0.39508 0.588865} H16 3230 0.0 -1 1 {} H 0.0 {0.746534 0.380293 0.594164} H17 3231 0.0 -1 7 {} N 0.0 {0.488766 0.291471 0.327435} N6 3232 0.0 -1 1 {} H 0.0 {0.480257 0.288113 0.331782} H41 3233 0.0 -1 1 {} H 0.0 {0.494056 0.295806 0.335387} H42 3234 0.0 -1 14 {} Si 0.0 {0.26927 0.543308 0.361958} Si6 3235 0.0 -1 8 {} O 0.0 {0.252835 0.478987 0.34702} O6 3236 0.0 -1 14 {} Si 0.0 {0.249607 0.491706 0.338614} Si7 3237 0.0 -1 8 {} O 0.0 {0.252657 0.501439 0.350248} O7 3238 0.0 -1 14 {} Si 0.0 {0.286746 0.501703 0.340858} Si8 3239 0.0 -1 7 {} N 0.0 {0.301989 0.501964 0.348171} N2 3240 0.0 -1 14 {} Si 0.0 {0.304222 0.516188 0.334536} Si9 3241 0.0 -1 14 {} Si 0.0 {0.301624 0.485175 0.350149} Si10 3242 0.0 -1 6 {} C 0.0 {0.347687 0.528447 0.335623} C3 3243 0.0 -1 7 {} N 0.0 {0.647551 0.59951 0.390485} N 3244 0.0 -1 8 {} O 0.0 {0.382433 0.437586 0.357678} O8 3245 0.0 -1 8 {} O 0.0 {0.26932 0.556031 0.372119} O9 3246 0.0 -1 8 {} O 0.0 {0.271734 0.559264 0.347422} O10 3247 0.0 -1 1 {} H 0.0 {0.261998 0.476196 0.345012} H18 3248 0.0 -1 1 {} H 0.0 {0.603161 0.227411 0.469618} H19 3249 0.0 -1 1 {} H 0.0 {0.298785 0.497047 0.315315} H20 3250 0.0 -1 1 {} H 0.0 {0.289234 0.521336 0.331301} H22 3251 0.0 -1 1 {} H 0.0 {0.290258 0.47996 0.340049} H24 3252 0.0 -1 1 {} H 0.0 {0.293123 0.480275 0.363208} H25 3253 0.0 -1 1 {} H 0.0 {0.347791 0.519376 0.341129} H26 3254 0.0 -1 1 {} H 0.0 {0.29161 0.482042 0.380873} H27 3255 0.0 -1 1 {} H 0.0 {0.346321 0.531639 0.360542} H28 3256 0.0 -1 1 {} H 0.0 {0.617651 0.62759 0.423496} H29 3257 0.0 -1 1 {} H 0.0 {0.640284 0.592214 0.389879} H31 3258 0.0 -1 1 {} H 0.0 {0.391231 0.436421 0.362197} H32 3259 0.0 -1 1 {} H 0.0 {0.276376 0.562001 0.36954} H33 3260 0.0 -1 1 {} H 0.0 {0.36657 0.560533 0.272646} H34 3261 0.0 -1 7 {} N 0.0 {0.317024 0.510026 0.320933} N3 3262 0.0 -1 1 {} H 0.0 {0.324511 0.507309 0.327332} H16 3263 0.0 -1 1 {} H 0.0 {0.319516 0.51852 0.316494} H17 3264 0.0 -1 7 {} N 0.0 {0.320505 0.479653 0.346797} N6 3265 0.0 -1 1 {} H 0.0 {0.324348 0.476143 0.355048} H41 3266 0.0 -1 1 {} H 0.0 {0.323329 0.489533 0.345761} H42 3267 0.0 -1 14 {} Si 0.0 {0.419793 0.358245 0.379279} Si6 3268 0.0 -1 8 {} O 0.0 {0.423403 0.370732 0.370111} O6 3269 0.0 -1 14 {} Si 0.0 {0.425807 0.386375 0.368527} Si7 3270 0.0 -1 8 {} O 0.0 {0.426153 0.391409 0.384336} O7 3271 0.0 -1 14 {} Si 0.0 {0.37258 0.39862 0.430988} Si8 3272 0.0 -1 7 {} N 0.0 {0.369451 0.411265 0.440622} N2 3273 0.0 -1 14 {} Si 0.0 {0.385881 0.419803 0.435678} Si9 3274 0.0 -1 14 {} Si 0.0 {0.351025 0.406202 0.442785} Si10 3275 0.0 -1 6 {} C 0.0 {0.41548 0.358831 0.401861} C3 3276 0.0 -1 7 {} N 0.0 {0.433109 0.393651 0.354846} N 3277 0.0 -1 8 {} O 0.0 {0.405404 0.389398 0.367624} O8 3278 0.0 -1 8 {} O 0.0 {0.431005 0.363378 0.395372} O9 3279 0.0 -1 8 {} O 0.0 {0.423461 0.344609 0.37117} O10 3280 0.0 -1 1 {} H 0.0 {0.334091 0.403594 0.409724} H18 3281 0.0 -1 1 {} H 0.0 {0.421117 0.399713 0.386532} H19 3282 0.0 -1 1 {} H 0.0 {0.348433 0.437835 0.451635} H20 3283 0.0 -1 1 {} H 0.0 {0.393259 0.415468 0.424833} H22 3284 0.0 -1 1 {} H 0.0 {0.350946 0.393513 0.444603} H24 3285 0.0 -1 1 {} H 0.0 {0.342489 0.409818 0.430486} H25 3286 0.0 -1 1 {} H 0.0 {0.40726 0.353737 0.396953} H26 3287 0.0 -1 1 {} H 0.0 {0.411101 0.367188 0.406183} H27 3288 0.0 -1 1 {} H 0.0 {0.418515 0.352454 0.409659} H28 3289 0.0 -1 1 {} H 0.0 {0.429906 0.389322 0.345807} H29 3290 0.0 -1 1 {} H 0.0 {0.428669 0.40316 0.354201} H31 3291 0.0 -1 1 {} H 0.0 {0.402585 0.392131 0.376582} H32 3292 0.0 -1 1 {} H 0.0 {0.429173 0.373161 0.39519} H33 3293 0.0 -1 1 {} H 0.0 {0.414047 0.343753 0.36054} H34 3294 0.0 -1 7 {} N 0.0 {0.379716 0.437532 0.431838} N3 3295 0.0 -1 1 {} H 0.0 {0.377707 0.43675 0.421912} H16 3296 0.0 -1 1 {} H 0.0 {0.370559 0.436896 0.436601} H17 3297 0.0 -1 7 {} N 0.0 {0.344749 0.415814 0.457978} N6 3298 0.0 -1 1 {} H 0.0 {0.340587 0.407853 0.462185} H41 3299 0.0 -1 1 {} H 0.0 {0.354289 0.416517 0.462004} H42 3300 0.0 -1 14 {} Si 0.0 {0.465994 0.201051 0.478378} Si6 3301 0.0 -1 8 {} O 0.0 {0.457628 0.217802 0.467878} O6 3302 0.0 -1 14 {} Si 0.0 {0.519143 0.234578 0.395853} Si7 3303 0.0 -1 8 {} O 0.0 {0.444453 0.276316 0.42317} O7 3304 0.0 -1 14 {} Si 0.0 {0.456077 0.274428 0.385543} Si8 3305 0.0 -1 7 {} N 0.0 {0.460075 0.314498 0.385067} N2 3306 0.0 -1 14 {} Si 0.0 {0.465954 0.298622 0.375748} Si9 3307 0.0 -1 14 {} Si 0.0 {0.469901 0.311624 0.397789} Si10 3308 0.0 -1 6 {} C 0.0 {0.646579 0.45746 0.357019} C3 3309 0.0 -1 7 {} N 0.0 {0.509248 0.245861 0.403974} N 3310 0.0 -1 8 {} O 0.0 {0.511914 0.224332 0.386482} O8 3311 0.0 -1 8 {} O 0.0 {0.450181 0.191867 0.466146} O9 3312 0.0 -1 8 {} O 0.0 {0.479597 0.211281 0.491311} O10 3313 0.0 -1 1 {} H 0.0 {0.460825 0.287312 0.379823} H18 3314 0.0 -1 1 {} H 0.0 {0.770754 0.504973 0.427053} H19 3315 0.0 -1 1 {} H 0.0 {0.471733 0.347143 0.372139} H20 3316 0.0 -1 1 {} H 0.0 {0.469703 0.357301 0.384742} H22 3317 0.0 -1 1 {} H 0.0 {0.466805 0.32256 0.410646} H24 3318 0.0 -1 1 {} H 0.0 {0.580272 0.26031 0.316303} H25 3319 0.0 -1 1 {} H 0.0 {0.650355 0.455145 0.366086} H26 3320 0.0 -1 1 {} H 0.0 {0.645418 0.468413 0.356508} H27 3321 0.0 -1 1 {} H 0.0 {0.652742 0.454707 0.349364} H28 3322 0.0 -1 1 {} H 0.0 {0.504076 0.252359 0.397421} H29 3323 0.0 -1 1 {} H 0.0 {0.503154 0.240982 0.410629} H31 3324 0.0 -1 1 {} H 0.0 {0.458286 0.235183 0.413661} H32 3325 0.0 -1 1 {} H 0.0 {0.449399 0.200471 0.461611} H33 3326 0.0 -1 1 {} H 0.0 {0.459697 0.186883 0.496498} H34 3327 0.0 -1 7 {} N 0.0 {0.47232 0.347412 0.382381} N3 3328 0.0 -1 1 {} H 0.0 {0.600898 0.261971 0.374775} H16 3329 0.0 -1 1 {} H 0.0 {0.464486 0.341457 0.385673} H17 3330 0.0 -1 7 {} N 0.0 {0.46547 0.297273 0.411118} N6 3331 0.0 -1 1 {} H 0.0 {0.456085 0.301453 0.409271} H41 3332 0.0 -1 1 {} H 0.0 {0.468145 0.301389 0.420149} H42 3333 0.0 -1 14 {} Si 0.0 {0.629143 0.56627 0.579403} Si6 3334 0.0 -1 8 {} O 0.0 {0.604477 0.573666 0.590221} O6 3335 0.0 -1 14 {} Si 0.0 {0.348863 0.380664 0.405308} Si7 3336 0.0 -1 8 {} O 0.0 {0.338622 0.377032 0.368336} O7 3337 0.0 -1 14 {} Si 0.0 {0.360706 0.400863 0.409648} Si8 3338 0.0 -1 7 {} N 0.0 {0.376154 0.398904 0.414749} N2 3339 0.0 -1 14 {} Si 0.0 {0.378642 0.395139 0.395392} Si9 3340 0.0 -1 14 {} Si 0.0 {0.378888 0.375674 0.442738} Si10 3341 0.0 -1 6 {} C 0.0 {0.641747 0.573643 0.588688} C3 3342 0.0 -1 7 {} N 0.0 {0.643227 0.683795 0.442554} N 3343 0.0 -1 8 {} O 0.0 {0.387365 0.365961 0.33572} O8 3344 0.0 -1 8 {} O 0.0 {0.472064 0.435279 0.796355} O9 3345 0.0 -1 8 {} O 0.0 {0.628887 0.565336 0.563857} O10 3346 0.0 -1 1 {} H 0.0 {0.480745 0.436335 0.795673} H18 3347 0.0 -1 1 {} H 0.0 {0.602839 0.263507 0.523508} H19 3348 0.0 -1 1 {} H 0.0 {0.377945 0.380819 0.395948} H20 3349 0.0 -1 1 {} H 0.0 {0.361526 0.381592 0.373266} H22 3350 0.0 -1 1 {} H 0.0 {0.362514 0.389425 0.437829} H24 3351 0.0 -1 1 {} H 0.0 {0.381494 0.361349 0.442239} H25 3352 0.0 -1 1 {} H 0.0 {0.650892 0.581474 0.613888} H26 3353 0.0 -1 1 {} H 0.0 {0.643316 0.582813 0.583239} H27 3354 0.0 -1 1 {} H 0.0 {0.650468 0.567551 0.588914} H28 3355 0.0 -1 1 {} H 0.0 {0.649735 0.676711 0.446062} H29 3356 0.0 -1 1 {} H 0.0 {0.643157 0.686898 0.432327} H31 3357 0.0 -1 1 {} H 0.0 {0.392696 0.37456 0.333626} H32 3358 0.0 -1 1 {} H 0.0 {0.470661 0.430893 0.786962} H33 3359 0.0 -1 1 {} H 0.0 {0.63335 0.557024 0.560848} H34 3360 0.0 -1 7 {} N 0.0 {0.396686 0.401283 0.393614} N3 3361 0.0 -1 1 {} H 0.0 {0.401766 0.395135 0.399721} H16 3362 0.0 -1 1 {} H 0.0 {0.396819 0.410344 0.398798} H17 3363 0.0 -1 7 {} N 0.0 {0.369356 0.232222 0.493126} N6 3364 0.0 -1 1 {} H 0.0 {0.365884 0.376678 0.444225} H41 3365 0.0 -1 1 {} H 0.0 {0.375952 0.229739 0.500443} H42 3366 0.0 -1 14 {} Si 0.0 {0.458201 0.614796 0.655453} Si6 3367 0.0 -1 8 {} O 0.0 {0.446132 0.623454 0.661606} O6 3368 0.0 -1 14 {} Si 0.0 {0.441226 0.637601 0.6661} Si7 3369 0.0 -1 8 {} O 0.0 {0.660641 0.524093 0.382791} O7 3370 0.0 -1 14 {} Si 0.0 {0.656387 0.523557 0.36779} Si8 3371 0.0 -1 7 {} N 0.0 {0.638599 0.545735 0.447175} N2 3372 0.0 -1 14 {} Si 0.0 {0.655293 0.536902 0.439273} Si9 3373 0.0 -1 14 {} Si 0.0 {0.697411 0.486301 0.37011} Si10 3374 0.0 -1 6 {} C 0.0 {0.588141 0.591744 0.326667} C3 3375 0.0 -1 7 {} N 0.0 {0.709148 0.501073 0.374664} N 3376 0.0 -1 8 {} O 0.0 {0.443731 0.635101 0.681502} O8 3377 0.0 -1 8 {} O 0.0 {0.636974 0.52021 0.409068} O9 3378 0.0 -1 8 {} O 0.0 {0.456168 0.59586 0.663591} O10 3379 0.0 -1 1 {} H 0.0 {0.534355 0.706763 0.402921} H18 3380 0.0 -1 1 {} H 0.0 {0.707113 0.475918 0.351234} H19 3381 0.0 -1 1 {} H 0.0 {0.66266 0.510803 0.363743} H20 3382 0.0 -1 1 {} H 0.0 {0.646102 0.528203 0.431893} H22 3383 0.0 -1 1 {} H 0.0 {0.679885 0.579359 0.334123} H24 3384 0.0 -1 1 {} H 0.0 {0.666554 0.650056 0.564533} H25 3385 0.0 -1 1 {} H 0.0 {0.586869 0.581308 0.329477} H26 3386 0.0 -1 1 {} H 0.0 {0.450407 0.623082 0.615074} H27 3387 0.0 -1 1 {} H 0.0 {0.598648 0.593767 0.327438} H28 3388 0.0 -1 1 {} H 0.0 {0.451241 0.656213 0.658682} H29 3389 0.0 -1 1 {} H 0.0 {0.711572 0.504299 0.36559} H31 3390 0.0 -1 1 {} H 0.0 {0.462541 0.652675 0.674435} H32 3391 0.0 -1 1 {} H 0.0 {0.629185 0.51475 0.411941} H33 3392 0.0 -1 1 {} H 0.0 {0.365549 0.526303 0.6581} H34 3393 0.0 -1 7 {} N 0.0 {0.663161 0.549109 0.42712} N3 3394 0.0 -1 1 {} H 0.0 {0.655384 0.554365 0.423691} H16 3395 0.0 -1 1 {} H 0.0 {0.667783 0.555746 0.43328} H17 3396 0.0 -1 7 {} N 0.0 {0.678641 0.487495 0.377906} N6 3397 0.0 -1 1 {} H 0.0 {0.672405 0.492754 0.383697} H41 3398 0.0 -1 1 {} H 0.0 {0.674951 0.477928 0.376944} H42 3399 0.0 -1 14 {} Si 0.0 {0.504144 0.602368 0.310713} Si6 3400 0.0 -1 8 {} O 0.0 {0.491802 0.593362 0.314452} O6 3401 0.0 -1 14 {} Si 0.0 {0.478936 0.585438 0.311624} Si7 3402 0.0 -1 8 {} O 0.0 {0.476621 0.579997 0.326257} O7 3403 0.0 -1 14 {} Si 0.0 {0.476216 0.567386 0.335525} Si8 3404 0.0 -1 7 {} N 0.0 {0.490565 0.560111 0.340038} N2 3405 0.0 -1 14 {} Si 0.0 {0.496699 0.551087 0.351915} Si9 3406 0.0 -1 14 {} Si 0.0 {0.50576 0.563617 0.332156} Si10 3407 0.0 -1 6 {} C 0.0 {0.503375 0.621188 0.311923} C3 3408 0.0 -1 7 {} N 0.0 {0.465298 0.590283 0.29978} N 3409 0.0 -1 8 {} O 0.0 {0.489351 0.56904 0.305906} O8 3410 0.0 -1 8 {} O 0.0 {0.51069 0.590634 0.29565} O9 3411 0.0 -1 8 {} O 0.0 {0.51407 0.594603 0.320311} O10 3412 0.0 -1 1 {} H 0.0 {0.470698 0.573197 0.351373} H18 3413 0.0 -1 1 {} H 0.0 {0.466654 0.557358 0.331069} H19 3414 0.0 -1 1 {} H 0.0 {0.489105 0.538646 0.346956} H20 3415 0.0 -1 1 {} H 0.0 {0.51488 0.548174 0.352084} H22 3416 0.0 -1 1 {} H 0.0 {0.495154 0.566416 0.317186} H24 3417 0.0 -1 1 {} H 0.0 {0.510037 0.547065 0.332787} H25 3418 0.0 -1 1 {} H 0.0 {0.501459 0.625682 0.302411} H26 3419 0.0 -1 1 {} H 0.0 {0.512423 0.625124 0.314579} H27 3420 0.0 -1 1 {} H 0.0 {0.495192 0.622431 0.318864} H28 3421 0.0 -1 1 {} H 0.0 {0.465005 0.582513 0.293471} H29 3422 0.0 -1 1 {} H 0.0 {0.457129 0.58958 0.306179} H31 3423 0.0 -1 1 {} H 0.0 {0.498247 0.572189 0.301805} H32 3424 0.0 -1 1 {} H 0.0 {0.507406 0.581681 0.299437} H33 3425 0.0 -1 1 {} H 0.0 {0.520667 0.589864 0.314921} H34 3426 0.0 -1 7 {} N 0.0 {0.487182 0.556219 0.368779} N3 3427 0.0 -1 1 {} H 0.0 {0.478257 0.558759 0.364395} H16 3428 0.0 -1 1 {} H 0.0 {0.492415 0.564834 0.371043} H17 3429 0.0 -1 7 {} N 0.0 {0.520122 0.575753 0.342086} N6 3430 0.0 -1 1 {} H 0.0 {0.523083 0.581514 0.334124} H41 3431 0.0 -1 1 {} H 0.0 {0.512892 0.58136 0.347261} H42 3432 0.0 -1 14 {} Si 0.0 {0.313235 0.45179 0.456246} Si6 3433 0.0 -1 8 {} O 0.0 {0.31795 0.446756 0.470894} O6 3434 0.0 -1 14 {} Si 0.0 {0.312361 0.440948 0.485386} Si7 3435 0.0 -1 8 {} O 0.0 {0.328192 0.43826 0.490652} O7 3436 0.0 -1 14 {} Si 0.0 {0.341018 0.43052 0.48495} Si8 3437 0.0 -1 7 {} N 0.0 {0.35729 0.432419 0.492295} N2 3438 0.0 -1 14 {} Si 0.0 {0.369567 0.423135 0.49833} Si9 3439 0.0 -1 14 {} Si 0.0 {0.364339 0.449048 0.499909} Si10 3440 0.0 -1 6 {} C 0.0 {0.324775 0.473659 0.480142} C3 3441 0.0 -1 7 {} N 0.0 {0.304626 0.446671 0.502803} N 3442 0.0 -1 8 {} O 0.0 {0.293298 0.435114 0.476071} O8 3443 0.0 -1 8 {} O 0.0 {0.215056 0.498453 0.483042} O9 3444 0.0 -1 8 {} O 0.0 {0.308537 0.433352 0.448803} O10 3445 0.0 -1 1 {} H 0.0 {0.336696 0.417515 0.484478} H18 3446 0.0 -1 1 {} H 0.0 {0.343836 0.438113 0.469223} H19 3447 0.0 -1 1 {} H 0.0 {0.37423 0.412891 0.487897} H20 3448 0.0 -1 1 {} H 0.0 {0.38195 0.430891 0.5008} H22 3449 0.0 -1 1 {} H 0.0 {0.376875 0.452043 0.490727} H24 3450 0.0 -1 1 {} H 0.0 {0.390958 0.444826 0.537261} H25 3451 0.0 -1 1 {} H 0.0 {0.326755 0.463322 0.482722} H26 3452 0.0 -1 1 {} H 0.0 {0.322898 0.477654 0.489864} H27 3453 0.0 -1 1 {} H 0.0 {0.316155 0.475241 0.474031} H28 3454 0.0 -1 1 {} H 0.0 {0.298815 0.438574 0.504473} H29 3455 0.0 -1 1 {} H 0.0 {0.298529 0.453608 0.498271} H31 3456 0.0 -1 1 {} H 0.0 {0.28745 0.435368 0.484031} H32 3457 0.0 -1 1 {} H 0.0 {0.208453 0.496077 0.490045} H33 3458 0.0 -1 1 {} H 0.0 {0.314258 0.432291 0.440596} H34 3459 0.0 -1 7 {} N 0.0 {0.363477 0.410629 0.51203} N3 3460 0.0 -1 1 {} H 0.0 {0.366729 0.415748 0.520459} H16 3461 0.0 -1 1 {} H 0.0 {0.353667 0.413297 0.512186} H17 3462 0.0 -1 7 {} N 0.0 {0.352507 0.463691 0.494989} N6 3463 0.0 -1 1 {} H 0.0 {0.347272 0.457914 0.48847} H41 3464 0.0 -1 1 {} H 0.0 {0.358208 0.46992 0.489217} H42 3465 0.0 -1 14 {} Si 0.0 {0.495439 0.566198 0.459751} Si6 3466 0.0 -1 8 {} O 0.0 {0.496898 0.581462 0.45501} O6 3467 0.0 -1 14 {} Si 0.0 {0.49988 0.595828 0.459875} Si7 3468 0.0 -1 8 {} O 0.0 {0.515571 0.595289 0.458496} O7 3469 0.0 -1 14 {} Si 0.0 {0.529657 0.588841 0.462618} Si8 3470 0.0 -1 7 {} N 0.0 {0.531445 0.577036 0.474563} N2 3471 0.0 -1 14 {} Si 0.0 {0.542372 0.56573 0.478997} Si9 3472 0.0 -1 14 {} Si 0.0 {0.520961 0.575889 0.4879} Si10 3473 0.0 -1 6 {} C 0.0 {0.486554 0.560842 0.475751} C3 3474 0.0 -1 7 {} N 0.0 {0.493174 0.613004 0.451466} N 3475 0.0 -1 8 {} O 0.0 {0.497824 0.595171 0.478025} O8 3476 0.0 -1 8 {} O 0.0 {0.510786 0.562555 0.458409} O9 3477 0.0 -1 8 {} O 0.0 {0.490167 0.560658 0.44104} O10 3478 0.0 -1 1 {} H 0.0 {0.535326 0.581481 0.447478} H18 3479 0.0 -1 1 {} H 0.0 {0.540189 0.600687 0.466318} H19 3480 0.0 -1 1 {} H 0.0 {0.557623 0.572235 0.473615} H20 3481 0.0 -1 1 {} H 0.0 {0.541147 0.563393 0.494162} H22 3482 0.0 -1 1 {} H 0.0 {0.508721 0.586634 0.482176} H24 3483 0.0 -1 1 {} H 0.0 {0.52552 0.583374 0.501005} H25 3484 0.0 -1 1 {} H 0.0 {0.48891 0.550671 0.477752} H26 3485 0.0 -1 1 {} H 0.0 {0.476696 0.562889 0.473885} H27 3486 0.0 -1 1 {} H 0.0 {0.490493 0.567699 0.482834} H28 3487 0.0 -1 1 {} H 0.0 {0.49255 0.614005 0.44131} H29 3488 0.0 -1 1 {} H 0.0 {0.483963 0.614765 0.455406} H31 3489 0.0 -1 1 {} H 0.0 {0.500856 0.604401 0.481309} H32 3490 0.0 -1 1 {} H 0.0 {0.515873 0.567367 0.465089} H33 3491 0.0 -1 1 {} H 0.0 {0.498545 0.560648 0.435844} H34 3492 0.0 -1 7 {} N 0.0 {0.539019 0.549775 0.467856} N3 3493 0.0 -1 1 {} H 0.0 {0.529174 0.552029 0.466103} H16 3494 0.0 -1 1 {} H 0.0 {0.54355 0.551745 0.458839} H17 3495 0.0 -1 7 {} N 0.0 {0.51288 0.557594 0.490412} N6 3496 0.0 -1 1 {} H 0.0 {0.519133 0.555655 0.498653} H41 3497 0.0 -1 1 {} H 0.0 {0.517181 0.553049 0.48249} H42 3498 0.0 -1 14 {} Si 0.0 {0.570552 0.416024 0.57473} Si6 3499 0.0 -1 8 {} O 0.0 {0.57081 0.402364 0.582006} O6 3500 0.0 -1 14 {} Si 0.0 {0.564931 0.388187 0.585525} Si7 3501 0.0 -1 8 {} O 0.0 {0.550876 0.387391 0.578758} O7 3502 0.0 -1 14 {} Si 0.0 {0.538162 0.394759 0.57457} Si8 3503 0.0 -1 7 {} N 0.0 {0.530229 0.402291 0.561678} N2 3504 0.0 -1 14 {} Si 0.0 {0.573615 0.343671 0.599583} Si9 3505 0.0 -1 14 {} Si 0.0 {0.52274 0.420261 0.559578} Si10 3506 0.0 -1 6 {} C 0.0 {0.575991 0.417282 0.556929} C3 3507 0.0 -1 7 {} N 0.0 {0.575016 0.373806 0.584271} N 3508 0.0 -1 8 {} O 0.0 {0.560121 0.393921 0.604848} O8 3509 0.0 -1 8 {} O 0.0 {0.578421 0.424286 0.587182} O9 3510 0.0 -1 8 {} O 0.0 {0.551518 0.421613 0.580692} O10 3511 0.0 -1 1 {} H 0.0 {0.529081 0.393751 0.584406} H18 3512 0.0 -1 1 {} H 0.0 {0.544624 0.410915 0.577735} H19 3513 0.0 -1 1 {} H 0.0 {0.572351 0.329938 0.603946} H20 3514 0.0 -1 1 {} H 0.0 {0.571132 0.348236 0.587267} H22 3515 0.0 -1 1 {} H 0.0 {0.42807 0.418005 0.62436} H24 3516 0.0 -1 1 {} H 0.0 {0.515151 0.394623 0.535568} H25 3517 0.0 -1 1 {} H 0.0 {0.585193 0.422779 0.557386} H26 3518 0.0 -1 1 {} H 0.0 {0.567442 0.421901 0.552218} H27 3519 0.0 -1 1 {} H 0.0 {0.578397 0.407795 0.55299} H28 3520 0.0 -1 1 {} H 0.0 {0.577822 0.372889 0.593889} H29 3521 0.0 -1 1 {} H 0.0 {0.583243 0.377442 0.579765} H31 3522 0.0 -1 1 {} H 0.0 {0.556342 0.403466 0.603178} H32 3523 0.0 -1 1 {} H 0.0 {0.587334 0.420424 0.589773} H33 3524 0.0 -1 1 {} H 0.0 {0.524229 0.395225 0.556776} H34 3525 0.0 -1 7 {} N 0.0 {0.590207 0.346592 0.603906} N3 3526 0.0 -1 1 {} H 0.0 {0.59491 0.347312 0.594752} H16 3527 0.0 -1 1 {} H 0.0 {0.601376 0.427994 0.508679} H17 3528 0.0 -1 7 {} N 0.0 {0.550142 0.449654 0.562691} N6 3529 0.0 -1 1 {} H 0.0 {0.542722 0.45403 0.568201} H41 3530 0.0 -1 1 {} H 0.0 {0.554892 0.442829 0.569204} H42 3531 0.0 -1 14 {} Si 0.0 {0.48596 0.194931 0.46335} Si6 3532 0.0 -1 8 {} O 0.0 {0.482641 0.208393 0.45494} O6 3533 0.0 -1 14 {} Si 0.0 {0.471806 0.221144 0.453135} Si7 3534 0.0 -1 8 {} O 0.0 {0.461346 0.217838 0.435338} O7 3535 0.0 -1 14 {} Si 0.0 {0.468079 0.22253 0.421075} Si8 3536 0.0 -1 7 {} N 0.0 {0.487364 0.226902 0.419692} N2 3537 0.0 -1 14 {} Si 0.0 {0.362507 0.584756 0.295333} Si9 3538 0.0 -1 14 {} Si 0.0 {0.491045 0.221576 0.434695} Si10 3539 0.0 -1 6 {} C 0.0 {0.50235 0.192269 0.472068} C3 3540 0.0 -1 7 {} N 0.0 {0.345162 0.652025 0.462025} N 3541 0.0 -1 8 {} O 0.0 {0.478856 0.235993 0.460575} O8 3542 0.0 -1 8 {} O 0.0 {0.478692 0.184863 0.453314} O9 3543 0.0 -1 8 {} O 0.0 {0.469431 0.185378 0.481961} O10 3544 0.0 -1 1 {} H 0.0 {0.489673 0.22127 0.411004} H18 3545 0.0 -1 1 {} H 0.0 {0.467411 0.208831 0.411485} H19 3546 0.0 -1 1 {} H 0.0 {0.365822 0.572269 0.291536} H20 3547 0.0 -1 1 {} H 0.0 {0.360504 0.58977 0.281882} H22 3548 0.0 -1 1 {} H 0.0 {0.48026 0.273225 0.421143} H24 3549 0.0 -1 1 {} H 0.0 {0.493478 0.232517 0.442476} H25 3550 0.0 -1 1 {} H 0.0 {0.505068 0.183206 0.467693} H26 3551 0.0 -1 1 {} H 0.0 {0.500392 0.19255 0.482787} H27 3552 0.0 -1 1 {} H 0.0 {0.508682 0.199901 0.468656} H28 3553 0.0 -1 1 {} H 0.0 {0.353887 0.655585 0.460153} H29 3554 0.0 -1 1 {} H 0.0 {0.338372 0.658355 0.458389} H31 3555 0.0 -1 1 {} H 0.0 {0.474518 0.236516 0.469683} H32 3556 0.0 -1 1 {} H 0.0 {0.469098 0.186774 0.453028} H33 3557 0.0 -1 1 {} H 0.0 {0.467253 0.179453 0.474303} H34 3558 0.0 -1 7 {} N 0.0 {0.376293 0.593643 0.305933} N3 3559 0.0 -1 1 {} H 0.0 {0.38198 0.599032 0.299685} H16 3560 0.0 -1 1 {} H 0.0 {0.381542 0.585042 0.307954} H17 3561 0.0 -1 7 {} N 0.0 {0.506432 0.210779 0.432601} N6 3562 0.0 -1 1 {} H 0.0 {0.505222 0.205215 0.440745} H41 3563 0.0 -1 1 {} H 0.0 {0.503927 0.205319 0.424621} H42 3564 0.0 -1 14 {} Si 0.0 {0.542358 0.40827 0.413726} Si6 3565 0.0 -1 8 {} O 0.0 {0.545468 0.413251 0.428648} O6 3566 0.0 -1 14 {} Si 0.0 {0.542862 0.413281 0.444417} Si7 3567 0.0 -1 8 {} O 0.0 {0.546368 0.398483 0.447332} O7 3568 0.0 -1 14 {} Si 0.0 {0.552812 0.384671 0.442281} Si8 3569 0.0 -1 7 {} N 0.0 {0.650047 0.359906 0.437917} N2 3570 0.0 -1 14 {} Si 0.0 {0.647023 0.34958 0.451262} Si9 3571 0.0 -1 14 {} Si 0.0 {0.637391 0.354712 0.427072} Si10 3572 0.0 -1 6 {} C 0.0 {0.55358 0.39972 0.404528} C3 3573 0.0 -1 7 {} N 0.0 {0.547171 0.427452 0.453777} N 3574 0.0 -1 8 {} O 0.0 {0.522327 0.412563 0.448907} O8 3575 0.0 -1 8 {} O 0.0 {0.535253 0.427075 0.408368} O9 3576 0.0 -1 8 {} O 0.0 {0.523854 0.403655 0.418176} O10 3577 0.0 -1 1 {} H 0.0 {0.565273 0.389094 0.441385} H18 3578 0.0 -1 1 {} H 0.0 {0.539904 0.371072 0.426291} H19 3579 0.0 -1 1 {} H 0.0 {0.659923 0.342367 0.45751} H20 3580 0.0 -1 1 {} H 0.0 {0.640012 0.334997 0.445407} H22 3581 0.0 -1 1 {} H 0.0 {0.625037 0.348198 0.434706} H24 3582 0.0 -1 1 {} H 0.0 {0.640516 0.344007 0.413828} H25 3583 0.0 -1 1 {} H 0.0 {0.553163 0.40462 0.394893} H26 3584 0.0 -1 1 {} H 0.0 {0.565515 0.523591 0.579952} H27 3585 0.0 -1 1 {} H 0.0 {0.577488 0.400195 0.426622} H28 3586 0.0 -1 1 {} H 0.0 {0.550487 0.424139 0.463502} H29 3587 0.0 -1 1 {} H 0.0 {0.540049 0.434433 0.454376} H31 3588 0.0 -1 1 {} H 0.0 {0.52056 0.402668 0.450647} H32 3589 0.0 -1 1 {} H 0.0 {0.52852 0.426958 0.415663} H33 3590 0.0 -1 1 {} H 0.0 {0.519511 0.411167 0.423017} H34 3591 0.0 -1 7 {} N 0.0 {0.634457 0.362649 0.462425} N3 3592 0.0 -1 1 {} H 0.0 {0.641664 0.370142 0.463651} H16 3593 0.0 -1 1 {} H 0.0 {0.629918 0.365768 0.453722} H17 3594 0.0 -1 7 {} N 0.0 {0.628655 0.367862 0.421121} N6 3595 0.0 -1 1 {} H 0.0 {0.622158 0.363649 0.413952} H41 3596 0.0 -1 1 {} H 0.0 {0.633185 0.37616 0.416654} H42 3597 0.0 -1 14 {} Si 0.0 {0.640679 0.311309 0.544529} Si6 3598 0.0 -1 8 {} O 0.0 {0.528683 0.702898 0.410747} O6 3599 0.0 -1 14 {} Si 0.0 {0.527899 0.686895 0.408747} Si7 3600 0.0 -1 8 {} O 0.0 {0.539001 0.680483 0.417377} O7 3601 0.0 -1 14 {} Si 0.0 {0.554781 0.680708 0.417591} Si8 3602 0.0 -1 7 {} N 0.0 {0.564935 0.693107 0.422588} N2 3603 0.0 -1 14 {} Si 0.0 {0.580535 0.69808 0.4227} Si9 3604 0.0 -1 14 {} Si 0.0 {0.554523 0.704022 0.429971} Si10 3605 0.0 -1 6 {} C 0.0 {0.563254 0.699295 0.358708} C3 3606 0.0 -1 7 {} N 0.0 {0.509679 0.678825 0.413258} N 3607 0.0 -1 8 {} O 0.0 {0.532434 0.683327 0.393598} O8 3608 0.0 -1 8 {} O 0.0 {0.641793 0.322074 0.526502} O9 3609 0.0 -1 8 {} O 0.0 {0.652237 0.300229 0.54103} O10 3610 0.0 -1 1 {} H 0.0 {0.557859 0.665722 0.427298} H18 3611 0.0 -1 1 {} H 0.0 {0.561342 0.681052 0.400143} H19 3612 0.0 -1 1 {} H 0.0 {0.581471 0.710274 0.416444} H20 3613 0.0 -1 1 {} H 0.0 {0.588073 0.700384 0.437587} H22 3614 0.0 -1 1 {} H 0.0 {0.548843 0.698768 0.444853} H24 3615 0.0 -1 1 {} H 0.0 {0.542762 0.703873 0.418914} H25 3616 0.0 -1 1 {} H 0.0 {0.571064 0.698173 0.351457} H26 3617 0.0 -1 1 {} H 0.0 {0.486154 0.299602 0.321744} H27 3618 0.0 -1 1 {} H 0.0 {0.560643 0.709496 0.359432} H28 3619 0.0 -1 1 {} H 0.0 {0.632824 0.323662 0.523235} H29 3620 0.0 -1 1 {} H 0.0 {0.50355 0.687525 0.412072} H31 3621 0.0 -1 1 {} H 0.0 {0.530588 0.691523 0.387926} H32 3622 0.0 -1 1 {} H 0.0 {0.644223 0.331604 0.529926} H33 3623 0.0 -1 1 {} H 0.0 {0.611788 0.302807 0.530552} H34 3624 0.0 -1 7 {} N 0.0 {0.592264 0.685999 0.414883} N3 3625 0.0 -1 1 {} H 0.0 {0.601713 0.686568 0.417983} H16 3626 0.0 -1 1 {} H 0.0 {0.589038 0.676642 0.416596} H17 3627 0.0 -1 7 {} N 0.0 {0.563409 0.721244 0.432451} N6 3628 0.0 -1 1 {} H 0.0 {0.571751 0.719567 0.437649} H41 3629 0.0 -1 1 {} H 0.0 {0.557053 0.725629 0.438894} H42 3630 0.0 -1 14 {} Si 0.0 {0.656396 0.424505 0.580567} Si6 3631 0.0 -1 8 {} O 0.0 {0.668657 0.428144 0.571657} O6 3632 0.0 -1 14 {} Si 0.0 {0.678185 0.438856 0.566617} Si7 3633 0.0 -1 8 {} O 0.0 {0.678465 0.435178 0.551331} O7 3634 0.0 -1 14 {} Si 0.0 {0.682993 0.426551 0.539824} Si8 3635 0.0 -1 7 {} N 0.0 {0.692403 0.413966 0.538055} N2 3636 0.0 -1 14 {} Si 0.0 {0.692589 0.397897 0.532302} Si9 3637 0.0 -1 14 {} Si 0.0 {0.706221 0.417936 0.546322} Si10 3638 0.0 -1 6 {} C 0.0 {0.657243 0.415461 0.596761} C3 3639 0.0 -1 7 {} N 0.0 {0.677773 0.458917 0.568233} N 3640 0.0 -1 8 {} O 0.0 {0.697008 0.432925 0.571599} O8 3641 0.0 -1 8 {} O 0.0 {0.644406 0.415296 0.564708} O9 3642 0.0 -1 8 {} O 0.0 {0.647911 0.438127 0.578786} O10 3643 0.0 -1 1 {} H 0.0 {0.679139 0.434898 0.526048} H18 3644 0.0 -1 1 {} H 0.0 {0.74299 0.440019 0.502539} H19 3645 0.0 -1 1 {} H 0.0 {0.698026 0.398482 0.51899} H20 3646 0.0 -1 1 {} H 0.0 {0.69884 0.38606 0.538966} H22 3647 0.0 -1 1 {} H 0.0 {0.70782 0.404926 0.556857} H24 3648 0.0 -1 1 {} H 0.0 {0.701045 0.428909 0.559656} H25 3649 0.0 -1 1 {} H 0.0 {0.646941 0.414656 0.59964} H26 3650 0.0 -1 1 {} H 0.0 {0.66312 0.422 0.603128} H27 3651 0.0 -1 1 {} H 0.0 {0.662567 0.40627 0.597344} H28 3652 0.0 -1 1 {} H 0.0 {0.681741 0.461988 0.577354} H29 3653 0.0 -1 1 {} H 0.0 {0.667484 0.459862 0.569958} H31 3654 0.0 -1 1 {} H 0.0 {0.694664 0.424046 0.575464} H32 3655 0.0 -1 1 {} H 0.0 {0.649275 0.421184 0.558844} H33 3656 0.0 -1 1 {} H 0.0 {0.648417 0.443174 0.587729} H34 3657 0.0 -1 7 {} N 0.0 {0.674855 0.390961 0.536112} N3 3658 0.0 -1 1 {} H 0.0 {0.676588 0.38345 0.542435} H16 3659 0.0 -1 1 {} H 0.0 {0.672873 0.387199 0.527415} H17 3660 0.0 -1 7 {} N 0.0 {0.723136 0.423529 0.535861} N6 3661 0.0 -1 1 {} H 0.0 {0.723078 0.433512 0.537181} H41 3662 0.0 -1 1 {} H 0.0 {0.719508 0.422819 0.526457} H42 3663 0.0 -1 14 {} Si 0.0 {0.59856 0.392193 0.539509} Si6 3664 0.0 -1 8 {} O 0.0 {0.611174 0.39251 0.530127} O6 3665 0.0 -1 14 {} Si 0.0 {0.625145 0.390241 0.524399} Si7 3666 0.0 -1 8 {} O 0.0 {0.633726 0.393257 0.536911} O7 3667 0.0 -1 14 {} Si 0.0 {0.643783 0.390141 0.548265} Si8 3668 0.0 -1 7 {} N 0.0 {0.644688 0.375071 0.557358} N2 3669 0.0 -1 14 {} Si 0.0 {0.636523 0.363959 0.549118} Si9 3670 0.0 -1 14 {} Si 0.0 {0.650824 0.366574 0.570267} Si10 3671 0.0 -1 6 {} C 0.0 {0.585801 0.37913 0.538607} C3 3672 0.0 -1 7 {} N 0.0 {0.625406 0.377319 0.512672} N 3673 0.0 -1 8 {} O 0.0 {0.630374 0.407097 0.51271} O8 3674 0.0 -1 8 {} O 0.0 {0.595363 0.407691 0.538622} O9 3675 0.0 -1 8 {} O 0.0 {0.610959 0.39312 0.556751} O10 3676 0.0 -1 1 {} H 0.0 {0.658157 0.389695 0.541826} H18 3677 0.0 -1 1 {} H 0.0 {0.643358 0.405653 0.557553} H19 3678 0.0 -1 1 {} H 0.0 {0.601983 0.291971 0.556597} H20 3679 0.0 -1 1 {} H 0.0 {0.621621 0.361754 0.552944} H22 3680 0.0 -1 1 {} H 0.0 {0.654042 0.375576 0.583123} H24 3681 0.0 -1 1 {} H 0.0 {0.663128 0.360997 0.564559} H25 3682 0.0 -1 1 {} H 0.0 {0.577529 0.383495 0.543466} H26 3683 0.0 -1 1 {} H 0.0 {0.589918 0.370046 0.542575} H27 3684 0.0 -1 1 {} H 0.0 {0.583617 0.378041 0.528536} H28 3685 0.0 -1 1 {} H 0.0 {0.624485 0.36818 0.516895} H29 3686 0.0 -1 1 {} H 0.0 {0.634889 0.37696 0.507661} H31 3687 0.0 -1 1 {} H 0.0 {0.638938 0.410407 0.516636} H32 3688 0.0 -1 1 {} H 0.0 {0.589249 0.410046 0.531079} H33 3689 0.0 -1 1 {} H 0.0 {0.618918 0.397071 0.55233} H34 3690 0.0 -1 7 {} N 0.0 {0.646322 0.350311 0.538459} N3 3691 0.0 -1 1 {} H 0.0 {0.646388 0.356106 0.529658} H16 3692 0.0 -1 1 {} H 0.0 {0.655584 0.350753 0.542132} H17 3693 0.0 -1 7 {} N 0.0 {0.640168 0.352682 0.579073} N6 3694 0.0 -1 1 {} H 0.0 {0.631194 0.357212 0.578604} H41 3695 0.0 -1 1 {} H 0.0 {0.639998 0.346299 0.570999} H42 3696 0.0 -1 14 {} Si 0.0 {0.427347 0.37455 0.772823} Si6 3697 0.0 -1 8 {} O 0.0 {0.430261 0.383001 0.785579} O6 3698 0.0 -1 14 {} Si 0.0 {0.439922 0.392144 0.760506} Si7 3699 0.0 -1 8 {} O 0.0 {0.436931 0.382851 0.748613} O7 3700 0.0 -1 14 {} Si 0.0 {0.442244 0.376476 0.735038} Si8 3701 0.0 -1 7 {} N 0.0 {0.375515 0.392328 0.695668} N2 3702 0.0 -1 14 {} Si 0.0 {0.463094 0.339707 0.743912} Si9 3703 0.0 -1 14 {} Si 0.0 {0.386783 0.379804 0.698011} Si10 3704 0.0 -1 6 {} C 0.0 {0.410722 0.371714 0.765687} C3 3705 0.0 -1 7 {} N 0.0 {0.437307 0.409763 0.760647} N 3706 0.0 -1 8 {} O 0.0 {0.401617 0.373147 0.683572} O8 3707 0.0 -1 8 {} O 0.0 {0.474705 0.398208 0.743268} O9 3708 0.0 -1 8 {} O 0.0 {0.440119 0.365418 0.77296} O10 3709 0.0 -1 1 {} H 0.0 {0.436603 0.387273 0.722917} H18 3710 0.0 -1 1 {} H 0.0 {0.423223 0.345077 0.736595} H19 3711 0.0 -1 1 {} H 0.0 {0.460437 0.35347 0.747494} H20 3712 0.0 -1 1 {} H 0.0 {0.460339 0.338997 0.730999} H22 3713 0.0 -1 1 {} H 0.0 {0.426372 0.377808 0.792689} H24 3714 0.0 -1 1 {} H 0.0 {0.3968 0.378664 0.676596} H25 3715 0.0 -1 1 {} H 0.0 {0.411223 0.373127 0.755443} H26 3716 0.0 -1 1 {} H 0.0 {0.402167 0.377237 0.769099} H27 3717 0.0 -1 1 {} H 0.0 {0.409154 0.361486 0.769662} H28 3718 0.0 -1 1 {} H 0.0 {0.444484 0.414457 0.76525} H29 3719 0.0 -1 1 {} H 0.0 {0.642217 0.327516 0.405827} H31 3720 0.0 -1 1 {} H 0.0 {0.400546 0.36436 0.679956} H32 3721 0.0 -1 1 {} H 0.0 {0.482853 0.397341 0.736826} H33 3722 0.0 -1 1 {} H 0.0 {0.45127 0.388921 0.76546} H34 3723 0.0 -1 7 {} N 0.0 {0.431906 0.708226 0.585835} N3 3724 0.0 -1 1 {} H 0.0 {0.438931 0.704111 0.591849} H16 3725 0.0 -1 1 {} H 0.0 {0.422127 0.708545 0.590234} H17 3726 0.0 -1 7 {} N 0.0 {0.400287 0.385348 0.710292} N6 3727 0.0 -1 1 {} H 0.0 {0.404754 0.391875 0.703898} H41 3728 0.0 -1 1 {} H 0.0 {0.407135 0.377631 0.709086} H42 3729 0.0 -1 14 {} Si 0.0 {0.428067 0.368488 0.453765} Si6 3730 0.0 -1 8 {} O 0.0 {0.416347 0.357978 0.452248} O6 3731 0.0 -1 14 {} Si 0.0 {0.403381 0.349804 0.448566} Si7 3732 0.0 -1 8 {} O 0.0 {0.394153 0.356718 0.458886} O7 3733 0.0 -1 14 {} Si 0.0 {0.387133 0.357992 0.47335} Si8 3734 0.0 -1 7 {} N 0.0 {0.381965 0.372543 0.479996} N2 3735 0.0 -1 14 {} Si 0.0 {0.38836 0.386221 0.466761} Si9 3736 0.0 -1 14 {} Si 0.0 {0.382752 0.377787 0.496379} Si10 3737 0.0 -1 6 {} C 0.0 {0.429301 0.380402 0.468074} C3 3738 0.0 -1 7 {} N 0.0 {0.402417 0.349489 0.429156} N 3739 0.0 -1 8 {} O 0.0 {0.405145 0.335946 0.456367} O8 3740 0.0 -1 8 {} O 0.0 {0.42681 0.37434 0.438651} O9 3741 0.0 -1 8 {} O 0.0 {0.442543 0.355869 0.44837} O10 3742 0.0 -1 1 {} H 0.0 {0.371561 0.350309 0.473551} H18 3743 0.0 -1 1 {} H 0.0 {0.396038 0.351518 0.484892} H19 3744 0.0 -1 1 {} H 0.0 {0.403155 0.379986 0.467659} H20 3745 0.0 -1 1 {} H 0.0 {0.383207 0.380551 0.45398} H22 3746 0.0 -1 1 {} H 0.0 {0.386801 0.391519 0.49799} H24 3747 0.0 -1 1 {} H 0.0 {0.390202 0.367982 0.503839} H25 3748 0.0 -1 1 {} H 0.0 {0.423035 0.388814 0.465856} H26 3749 0.0 -1 1 {} H 0.0 {0.439401 0.38288 0.468923} H27 3750 0.0 -1 1 {} H 0.0 {0.425732 0.374121 0.476219} H28 3751 0.0 -1 1 {} H 0.0 {0.404061 0.359571 0.427663} H29 3752 0.0 -1 1 {} H 0.0 {0.392049 0.348745 0.429345} H31 3753 0.0 -1 1 {} H 0.0 {0.414587 0.332574 0.454754} H32 3754 0.0 -1 1 {} H 0.0 {0.422648 0.367662 0.433396} H33 3755 0.0 -1 1 {} H 0.0 {0.437039 0.349216 0.444514} H34 3756 0.0 -1 7 {} N 0.0 {0.377455 0.400647 0.474866} N3 3757 0.0 -1 1 {} H 0.0 {0.373205 0.406571 0.467717} H16 3758 0.0 -1 1 {} H 0.0 {0.369495 0.394245 0.477339} H17 3759 0.0 -1 7 {} N 0.0 {0.364126 0.376872 0.502128} N6 3760 0.0 -1 1 {} H 0.0 {0.361685 0.386226 0.500279} H41 3761 0.0 -1 1 {} H 0.0 {0.361429 0.372284 0.493684} H42 3762 0.0 -1 14 {} Si 0.0 {0.309679 0.557661 0.522856} Si6 3763 0.0 -1 8 {} O 0.0 {0.318924 0.55584 0.510796} O6 3764 0.0 -1 14 {} Si 0.0 {0.32344 0.5544 0.495006} Si7 3765 0.0 -1 8 {} O 0.0 {0.309089 0.550129 0.490564} O7 3766 0.0 -1 14 {} Si 0.0 {0.294582 0.550849 0.484601} Si8 3767 0.0 -1 7 {} N 0.0 {0.287643 0.56818 0.479022} N2 3768 0.0 -1 14 {} Si 0.0 {0.293882 0.580928 0.486669} Si9 3769 0.0 -1 14 {} Si 0.0 {0.27818 0.569189 0.465985} Si10 3770 0.0 -1 6 {} C 0.0 {0.29174 0.553462 0.526103} C3 3771 0.0 -1 7 {} N 0.0 {0.330378 0.570407 0.487829} N 3772 0.0 -1 8 {} O 0.0 {0.330696 0.539675 0.493356} O8 3773 0.0 -1 8 {} O 0.0 {0.317992 0.569544 0.529204} O9 3774 0.0 -1 8 {} O 0.0 {0.326499 0.51831 0.513397} O10 3775 0.0 -1 1 {} H 0.0 {0.293927 0.540327 0.475069} H18 3776 0.0 -1 1 {} H 0.0 {0.286034 0.545644 0.495585} H19 3777 0.0 -1 1 {} H 0.0 {0.308333 0.576903 0.484811} H20 3778 0.0 -1 1 {} H 0.0 {0.290997 0.597192 0.480648} H22 3779 0.0 -1 1 {} H 0.0 {0.284539 0.568743 0.449355} H24 3780 0.0 -1 1 {} H 0.0 {0.278702 0.584217 0.457441} H25 3781 0.0 -1 1 {} H 0.0 {0.287304 0.559932 0.53302} H26 3782 0.0 -1 1 {} H 0.0 {0.291939 0.543707 0.529486} H27 3783 0.0 -1 1 {} H 0.0 {0.285205 0.553705 0.517359} H28 3784 0.0 -1 1 {} H 0.0 {0.340555 0.569156 0.488368} H29 3785 0.0 -1 1 {} H 0.0 {0.328248 0.577723 0.494662} H31 3786 0.0 -1 1 {} H 0.0 {0.33981 0.539773 0.497055} H32 3787 0.0 -1 1 {} H 0.0 {0.317566 0.577557 0.524057} H33 3788 0.0 -1 1 {} H 0.0 {0.322643 0.525841 0.507816} H34 3789 0.0 -1 7 {} N 0.0 {0.289433 0.583116 0.505591} N3 3790 0.0 -1 1 {} H 0.0 {0.281448 0.576548 0.505708} H16 3791 0.0 -1 1 {} H 0.0 {0.285529 0.592243 0.505697} H17 3792 0.0 -1 7 {} N 0.0 {0.258221 0.562781 0.468129} N6 3793 0.0 -1 1 {} H 0.0 {0.254613 0.566131 0.458912} H41 3794 0.0 -1 1 {} H 0.0 {0.255477 0.570812 0.474484} H42 3795 0.0 -1 14 {} Si 0.0 {0.442688 0.50446 0.38782} Si6 3796 0.0 -1 8 {} O 0.0 {0.434872 0.501497 0.373966} O6 3797 0.0 -1 14 {} Si 0.0 {0.42457 0.499827 0.3624} Si7 3798 0.0 -1 8 {} O 0.0 {0.432313 0.506641 0.350769} O7 3799 0.0 -1 14 {} Si 0.0 {0.435703 0.514207 0.33722} Si8 3800 0.0 -1 7 {} N 0.0 {0.453752 0.515078 0.330195} N2 3801 0.0 -1 14 {} Si 0.0 {0.456702 0.512029 0.313636} Si9 3802 0.0 -1 14 {} Si 0.0 {0.463706 0.514949 0.343292} Si10 3803 0.0 -1 6 {} C 0.0 {0.453418 0.492811 0.395664} C3 3804 0.0 -1 7 {} N 0.0 {0.414768 0.485724 0.363232} N 3805 0.0 -1 8 {} O 0.0 {0.410665 0.514896 0.367224} O8 3806 0.0 -1 8 {} O 0.0 {0.42483 0.499808 0.409275} O9 3807 0.0 -1 8 {} O 0.0 {0.44407 0.519771 0.385555} O10 3808 0.0 -1 1 {} H 0.0 {0.426586 0.507223 0.326078} H18 3809 0.0 -1 1 {} H 0.0 {0.429497 0.528529 0.338218} H19 3810 0.0 -1 1 {} H 0.0 {0.411427 0.541389 0.340444} H20 3811 0.0 -1 1 {} H 0.0 {0.45269 0.52326 0.306573} H22 3812 0.0 -1 1 {} H 0.0 {0.465872 0.502095 0.349961} H24 3813 0.0 -1 1 {} H 0.0 {0.455631 0.525524 0.352665} H25 3814 0.0 -1 1 {} H 0.0 {0.460593 0.498768 0.400322} H26 3815 0.0 -1 1 {} H 0.0 {0.344489 0.470849 0.568185} H27 3816 0.0 -1 1 {} H 0.0 {0.458423 0.487358 0.388272} H28 3817 0.0 -1 1 {} H 0.0 {0.420603 0.476834 0.364828} H29 3818 0.0 -1 1 {} H 0.0 {0.407202 0.485855 0.369571} H31 3819 0.0 -1 1 {} H 0.0 {0.409502 0.514668 0.377174} H32 3820 0.0 -1 1 {} H 0.0 {0.431131 0.506232 0.402034} H33 3821 0.0 -1 1 {} H 0.0 {0.453167 0.522877 0.382853} H34 3822 0.0 -1 7 {} N 0.0 {0.475477 0.509429 0.309893} N3 3823 0.0 -1 1 {} H 0.0 {0.47556 0.500638 0.31446} H16 3824 0.0 -1 1 {} H 0.0 {0.478522 0.515726 0.317456} H17 3825 0.0 -1 7 {} N 0.0 {0.480415 0.524891 0.340627} N6 3826 0.0 -1 1 {} H 0.0 {0.487373 0.518119 0.340605} H41 3827 0.0 -1 1 {} H 0.0 {0.478665 0.527786 0.330967} H42 3828 0.0 -1 14 {} Si 0.0 {0.655435 0.544423 0.544894} Si6 3829 0.0 -1 8 {} O 0.0 {0.377299 0.337182 0.382004} O6 3830 0.0 -1 14 {} Si 0.0 {0.377053 0.353147 0.383525} Si7 3831 0.0 -1 8 {} O 0.0 {0.734219 0.507452 0.496491} O7 3832 0.0 -1 14 {} Si 0.0 {0.397252 0.361349 0.364744} Si8 3833 0.0 -1 7 {} N 0.0 {0.659835 0.523966 0.53704} N2 3834 0.0 -1 14 {} Si 0.0 {0.400949 0.34139 0.349931} Si9 3835 0.0 -1 14 {} Si 0.0 {0.664012 0.508475 0.535849} Si10 3836 0.0 -1 6 {} C 0.0 {0.666277 0.534824 0.534369} C3 3837 0.0 -1 7 {} N 0.0 {0.359842 0.359464 0.379958} N 3838 0.0 -1 8 {} O 0.0 {0.385154 0.354765 0.396513} O8 3839 0.0 -1 8 {} O 0.0 {0.634609 0.54037 0.545646} O9 3840 0.0 -1 8 {} O 0.0 {0.661025 0.560088 0.575582} O10 3841 0.0 -1 1 {} H 0.0 {0.387721 0.357884 0.373509} H18 3842 0.0 -1 1 {} H 0.0 {0.401758 0.377391 0.367232} H19 3843 0.0 -1 1 {} H 0.0 {0.416347 0.359449 0.317399} H20 3844 0.0 -1 1 {} H 0.0 {0.390239 0.362787 0.350617} H22 3845 0.0 -1 1 {} H 0.0 {0.655331 0.495219 0.513677} H24 3846 0.0 -1 1 {} H 0.0 {0.668705 0.504242 0.548919} H25 3847 0.0 -1 1 {} H 0.0 {0.674184 0.539107 0.528657} H26 3848 0.0 -1 1 {} H 0.0 {0.390307 0.323105 0.356542} H27 3849 0.0 -1 1 {} H 0.0 {0.696069 0.524686 0.508605} H28 3850 0.0 -1 1 {} H 0.0 {0.356037 0.362002 0.388803} H29 3851 0.0 -1 1 {} H 0.0 {0.35492 0.351015 0.377311} H31 3852 0.0 -1 1 {} H 0.0 {0.379882 0.355572 0.404901} H32 3853 0.0 -1 1 {} H 0.0 {0.632186 0.531982 0.550322} H33 3854 0.0 -1 1 {} H 0.0 {0.377704 0.296126 0.407986} H34 3855 0.0 -1 7 {} N 0.0 {0.386553 0.331357 0.352169} N3 3856 0.0 -1 1 {} H 0.0 {0.074373 0.981612 0.869667} H16 3857 0.0 -1 1 {} H 0.0 {0.0816921 0.979658 0.871174} H17 3858 0.0 -1 7 {} N 0.0 {0.67588 0.505276 0.520427} N6 3859 0.0 -1 1 {} H 0.0 {0.685053 0.50571 0.525094} H41 3860 0.0 -1 1 {} H 0.0 {0.675824 0.51477 0.517393} H42 3861 0.0 -1 14 {} Si 0.0 {0.571186 0.478438 0.634669} Si6 3862 0.0 -1 8 {} O 0.0 {0.558265 0.468437 0.636314} O6 3863 0.0 -1 14 {} Si 0.0 {0.543336 0.466027 0.632483} Si7 3864 0.0 -1 8 {} O 0.0 {0.539929 0.476599 0.618691} O7 3865 0.0 -1 14 {} Si 0.0 {0.530834 0.473376 0.606264} Si8 3866 0.0 -1 7 {} N 0.0 {0.522155 0.456273 0.614391} N2 3867 0.0 -1 14 {} Si 0.0 {0.509629 0.446357 0.609461} Si9 3868 0.0 -1 14 {} Si 0.0 {0.511663 0.469331 0.623032} Si10 3869 0.0 -1 6 {} C 0.0 {0.593002 0.472647 0.631279} C3 3870 0.0 -1 7 {} N 0.0 {0.533124 0.449708 0.625761} N 3871 0.0 -1 8 {} O 0.0 {0.537171 0.47635 0.64299} O8 3872 0.0 -1 8 {} O 0.0 {0.580772 0.470142 0.618884} O9 3873 0.0 -1 8 {} O 0.0 {0.563603 0.489443 0.626264} O10 3874 0.0 -1 1 {} H 0.0 {0.526348 0.48711 0.602118} H18 3875 0.0 -1 1 {} H 0.0 {0.541988 0.470297 0.594042} H19 3876 0.0 -1 1 {} H 0.0 {0.511829 0.43587 0.621982} H20 3877 0.0 -1 1 {} H 0.0 {0.494368 0.447515 0.609489} H22 3878 0.0 -1 1 {} H 0.0 {0.501694 0.476554 0.616289} H24 3879 0.0 -1 1 {} H 0.0 {0.520559 0.480138 0.629377} H25 3880 0.0 -1 1 {} H 0.0 {0.599956 0.477981 0.625655} H26 3881 0.0 -1 1 {} H 0.0 {0.596284 0.462414 0.633388} H27 3882 0.0 -1 1 {} H 0.0 {0.594635 0.476763 0.640198} H28 3883 0.0 -1 1 {} H 0.0 {0.540506 0.443082 0.621634} H29 3884 0.0 -1 1 {} H 0.0 {0.529407 0.444321 0.633799} H31 3885 0.0 -1 1 {} H 0.0 {0.53539 0.470684 0.651272} H32 3886 0.0 -1 1 {} H 0.0 {0.58169 0.478201 0.613751} H33 3887 0.0 -1 1 {} H 0.0 {0.553179 0.487247 0.625284} H34 3888 0.0 -1 7 {} N 0.0 {0.515571 0.438388 0.592631} N3 3889 0.0 -1 1 {} H 0.0 {0.509432 0.443824 0.586926} H16 3890 0.0 -1 1 {} H 0.0 {0.524869 0.442742 0.592435} H17 3891 0.0 -1 7 {} N 0.0 {0.507702 0.463906 0.641136} N6 3892 0.0 -1 1 {} H 0.0 {0.515561 0.457589 0.642208} H41 3893 0.0 -1 1 {} H 0.0 {0.510412 0.47241 0.646266} H42 3894 0.0 -1 14 {} Si 0.0 {0.451138 0.395736 0.421522} Si6 3895 0.0 -1 8 {} O 0.0 {0.458989 0.40916 0.422833} O6 3896 0.0 -1 14 {} Si 0.0 {0.458871 0.424173 0.428058} Si7 3897 0.0 -1 8 {} O 0.0 {0.451098 0.423415 0.442455} O7 3898 0.0 -1 14 {} Si 0.0 {0.441873 0.413396 0.45106} Si8 3899 0.0 -1 7 {} N 0.0 {0.422621 0.409226 0.448536} N2 3900 0.0 -1 14 {} Si 0.0 {0.4037 0.413508 0.45464} Si9 3901 0.0 -1 14 {} Si 0.0 {0.421878 0.429107 0.449126} Si10 3902 0.0 -1 6 {} C 0.0 {0.434712 0.395805 0.412723} C3 3903 0.0 -1 7 {} N 0.0 {0.474031 0.432672 0.4242} N 3904 0.0 -1 8 {} O 0.0 {0.442848 0.431306 0.417854} O8 3905 0.0 -1 8 {} O 0.0 {0.452685 0.38754 0.440922} O9 3906 0.0 -1 8 {} O 0.0 {0.463832 0.388894 0.41464} O10 3907 0.0 -1 1 {} H 0.0 {0.448648 0.397948 0.444772} H18 3908 0.0 -1 1 {} H 0.0 {0.446669 0.412921 0.463964} H19 3909 0.0 -1 1 {} H 0.0 {0.394698 0.416821 0.444829} H20 3910 0.0 -1 1 {} H 0.0 {0.396265 0.400566 0.461052} H22 3911 0.0 -1 1 {} H 0.0 {0.458993 0.439742 0.452914} H24 3912 0.0 -1 1 {} H 0.0 {0.423612 0.436558 0.460551} H25 3913 0.0 -1 1 {} H 0.0 {0.434262 0.406433 0.410329} H26 3914 0.0 -1 1 {} H 0.0 {0.42778 0.392712 0.419983} H27 3915 0.0 -1 1 {} H 0.0 {0.434897 0.3896 0.403943} H28 3916 0.0 -1 1 {} H 0.0 {0.470048 0.439734 0.418044} H29 3917 0.0 -1 1 {} H 0.0 {0.479074 0.427063 0.417626} H31 3918 0.0 -1 1 {} H 0.0 {0.437931 0.435928 0.425382} H32 3919 0.0 -1 1 {} H 0.0 {0.444784 0.382074 0.44109} H33 3920 0.0 -1 1 {} H 0.0 {0.469191 0.384998 0.421171} H34 3921 0.0 -1 7 {} N 0.0 {0.403593 0.426134 0.469615} N3 3922 0.0 -1 1 {} H 0.0 {0.395647 0.422218 0.474856} H16 3923 0.0 -1 1 {} H 0.0 {0.399043 0.433135 0.463481} H17 3924 0.0 -1 7 {} N 0.0 {0.419617 0.438653 0.433259} N6 3925 0.0 -1 1 {} H 0.0 {0.409674 0.437346 0.432528} H41 3926 0.0 -1 1 {} H 0.0 {0.419632 0.448682 0.434572} H42 3927 0.0 -1 14 {} Si 0.0 {0.198813 0.572638 0.601038} Si6 3928 0.0 -1 8 {} O 0.0 {0.211396 0.576874 0.592684} O6 3929 0.0 -1 14 {} Si 0.0 {0.214836 0.588488 0.582712} Si7 3930 0.0 -1 8 {} O 0.0 {0.220078 0.599878 0.592255} O7 3931 0.0 -1 14 {} Si 0.0 {0.231469 0.610756 0.596869} Si8 3932 0.0 -1 7 {} N 0.0 {0.250618 0.60839 0.59379} N2 3933 0.0 -1 14 {} Si 0.0 {0.249374 0.592259 0.596637} Si9 3934 0.0 -1 14 {} Si 0.0 {0.266675 0.612642 0.590246} Si10 3935 0.0 -1 6 {} C 0.0 {0.189122 0.584359 0.611863} C3 3936 0.0 -1 7 {} N 0.0 {0.224983 0.582205 0.568706} N 3937 0.0 -1 8 {} O 0.0 {0.197478 0.597044 0.578094} O8 3938 0.0 -1 8 {} O 0.0 {0.209459 0.556429 0.611048} O9 3939 0.0 -1 8 {} O 0.0 {0.19245 0.563083 0.590005} O10 3940 0.0 -1 1 {} H 0.0 {0.228972 0.623134 0.586477} H18 3941 0.0 -1 1 {} H 0.0 {0.228591 0.614635 0.612015} H19 3942 0.0 -1 1 {} H 0.0 {0.254195 0.589957 0.612747} H20 3943 0.0 -1 1 {} H 0.0 {0.234861 0.587827 0.596604} H22 3944 0.0 -1 1 {} H 0.0 {0.269538 0.60883 0.575139} H24 3945 0.0 -1 1 {} H 0.0 {0.354236 0.337444 0.639029} H25 3946 0.0 -1 1 {} H 0.0 {0.1791 0.581507 0.610664} H26 3947 0.0 -1 1 {} H 0.0 {0.189668 0.593787 0.607255} H27 3948 0.0 -1 1 {} H 0.0 {0.191082 0.584481 0.622284} H28 3949 0.0 -1 1 {} H 0.0 {0.23401 0.584918 0.572384} H29 3950 0.0 -1 1 {} H 0.0 {0.225148 0.572512 0.569497} H31 3951 0.0 -1 1 {} H 0.0 {0.199083 0.60581 0.582145} H32 3952 0.0 -1 1 {} H 0.0 {0.20548 0.547962 0.606855} H33 3953 0.0 -1 1 {} H 0.0 {0.192528 0.567484 0.581042} H34 3954 0.0 -1 7 {} N 0.0 {0.470879 0.498869 0.814287} N3 3955 0.0 -1 1 {} H 0.0 {0.47589 0.497322 0.823331} H16 3956 0.0 -1 1 {} H 0.0 {0.47219 0.489578 0.808833} H17 3957 0.0 -1 7 {} N 0.0 {0.266914 0.631557 0.587605} N6 3958 0.0 -1 1 {} H 0.0 {0.270021 0.632008 0.577946} H41 3959 0.0 -1 1 {} H 0.0 {0.256701 0.631665 0.587133} H42 3960 0.0 -1 14 {} Si 0.0 {0.294224 0.292997 0.552056} Si6 3961 0.0 -1 8 {} O 0.0 {0.317679 0.290181 0.536799} O6 3962 0.0 -1 14 {} Si 0.0 {0.309816 0.30391 0.534061} Si7 3963 0.0 -1 8 {} O 0.0 {0.33376 0.317238 0.521356} O7 3964 0.0 -1 14 {} Si 0.0 {0.359152 0.306079 0.556789} Si8 3965 0.0 -1 7 {} N 0.0 {0.352535 0.303211 0.541077} N2 3966 0.0 -1 14 {} Si 0.0 {0.355123 0.294713 0.526792} Si9 3967 0.0 -1 14 {} Si 0.0 {0.334727 0.310955 0.536339} Si10 3968 0.0 -1 6 {} C 0.0 {0.300979 0.296251 0.568162} C3 3969 0.0 -1 7 {} N 0.0 {0.306089 0.307006 0.514584} N 3970 0.0 -1 8 {} O 0.0 {0.353122 0.313765 0.569955} O8 3971 0.0 -1 8 {} O 0.0 {0.294735 0.279362 0.543669} O9 3972 0.0 -1 8 {} O 0.0 {0.281355 0.300189 0.545356} O10 3973 0.0 -1 1 {} H 0.0 {0.371571 0.315863 0.552265} H18 3974 0.0 -1 1 {} H 0.0 {0.365893 0.294141 0.562355} H19 3975 0.0 -1 1 {} H 0.0 {0.344645 0.28772 0.520705} H20 3976 0.0 -1 1 {} H 0.0 {0.369079 0.303873 0.507926} H22 3977 0.0 -1 1 {} H 0.0 {0.331517 0.294347 0.538941} H24 3978 0.0 -1 1 {} H 0.0 {0.341338 0.313569 0.517157} H25 3979 0.0 -1 1 {} H 0.0 {0.292705 0.295218 0.575439} H26 3980 0.0 -1 1 {} H 0.0 {0.303932 0.306342 0.567609} H27 3981 0.0 -1 1 {} H 0.0 {0.309496 0.283084 0.573651} H28 3982 0.0 -1 1 {} H 0.0 {0.310737 0.298321 0.511376} H29 3983 0.0 -1 1 {} H 0.0 {0.295625 0.305334 0.513921} H31 3984 0.0 -1 1 {} H 0.0 {0.328387 0.351311 0.539859} H32 3985 0.0 -1 1 {} H 0.0 {0.303229 0.275512 0.544756} H33 3986 0.0 -1 1 {} H 0.0 {0.277392 0.293461 0.540121} H34 3987 0.0 -1 7 {} N 0.0 {0.369426 0.28156 0.529773} N3 3988 0.0 -1 1 {} H 0.0 {0.369023 0.274388 0.522409} H16 3989 0.0 -1 1 {} H 0.0 {0.377576 0.287279 0.526791} H17 3990 0.0 -1 7 {} N 0.0 {0.33455 0.325916 0.550124} N6 3991 0.0 -1 1 {} H 0.0 {0.339057 0.319317 0.556859} H41 3992 0.0 -1 1 {} H 0.0 {0.324073 0.323688 0.550624} H42 3993 0.0 -1 14 {} Si 0.0 {0.310109 0.321876 0.589607} Si6 3994 0.0 -1 8 {} O 0.0 {0.304511 0.336765 0.591939} O6 3995 0.0 -1 14 {} Si 0.0 {0.307216 0.351614 0.594443} Si7 3996 0.0 -1 8 {} O 0.0 {0.322786 0.353864 0.597888} O7 3997 0.0 -1 14 {} Si 0.0 {0.333665 0.362626 0.604945} Si8 3998 0.0 -1 7 {} N 0.0 {0.336279 0.368007 0.61973} N2 3999 0.0 -1 14 {} Si 0.0 {0.34696 0.369309 0.631583} Si9 4000 0.0 -1 14 {} Si 0.0 {0.321348 0.372009 0.625771} Si10 4001 0.0 -1 6 {} C 0.0 {0.321778 0.315927 0.577738} C3 4002 0.0 -1 7 {} N 0.0 {0.298979 0.364102 0.585458} N 4003 0.0 -1 8 {} O 0.0 {0.301515 0.351753 0.614959} O8 4004 0.0 -1 8 {} O 0.0 {0.295817 0.314803 0.591506} O9 4005 0.0 -1 8 {} O 0.0 {0.314282 0.322912 0.611285} O10 4006 0.0 -1 1 {} H 0.0 {0.335308 0.298006 0.557733} H18 4007 0.0 -1 1 {} H 0.0 {0.338712 0.373803 0.594677} H19 4008 0.0 -1 1 {} H 0.0 {0.338987 0.374795 0.644704} H20 4009 0.0 -1 1 {} H 0.0 {0.354633 0.354739 0.636082} H22 4010 0.0 -1 1 {} H 0.0 {0.318104 0.364605 0.641776} H24 4011 0.0 -1 1 {} H 0.0 {0.309926 0.359134 0.618756} H25 4012 0.0 -1 1 {} H 0.0 {0.31778 0.315965 0.567899} H26 4013 0.0 -1 1 {} H 0.0 {0.323998 0.30159 0.585547} H27 4014 0.0 -1 1 {} H 0.0 {0.33113 0.320448 0.577652} H28 4015 0.0 -1 1 {} H 0.0 {0.305822 0.370282 0.581002} H29 4016 0.0 -1 1 {} H 0.0 {0.294482 0.358883 0.578016} H31 4017 0.0 -1 1 {} H 0.0 {0.293389 0.357635 0.614489} H32 4018 0.0 -1 1 {} H 0.0 {0.295116 0.310156 0.600618} H33 4019 0.0 -1 1 {} H 0.0 {0.313388 0.333181 0.610261} H34 4020 0.0 -1 7 {} N 0.0 {0.3639 0.378125 0.626521} N3 4021 0.0 -1 1 {} H 0.0 {0.363099 0.386891 0.631775} H16 4022 0.0 -1 1 {} H 0.0 {0.369196 0.371623 0.633351} H17 4023 0.0 -1 7 {} N 0.0 {0.316191 0.391265 0.626043} N6 4024 0.0 -1 1 {} H 0.0 {0.307984 0.392181 0.632287} H41 4025 0.0 -1 1 {} H 0.0 {0.323126 0.395631 0.631705} H42 4026 0.0 -1 14 {} Si 0.0 {0.471872 0.319671 0.436667} Si6 4027 0.0 -1 8 {} O 0.0 {0.484204 0.314298 0.428237} O6 4028 0.0 -1 14 {} Si 0.0 {0.498261 0.307677 0.426823} Si7 4029 0.0 -1 8 {} O 0.0 {0.501314 0.313174 0.412281} O7 4030 0.0 -1 14 {} Si 0.0 {0.498847 0.311088 0.396483} Si8 4031 0.0 -1 7 {} N 0.0 {0.506728 0.296788 0.386476} N2 4032 0.0 -1 14 {} Si 0.0 {0.517986 0.294761 0.375024} Si9 4033 0.0 -1 14 {} Si 0.0 {0.505639 0.282942 0.393856} Si10 4034 0.0 -1 6 {} C 0.0 {0.462607 0.307488 0.447338} C3 4035 0.0 -1 7 {} N 0.0 {0.511037 0.307392 0.440143} N 4036 0.0 -1 8 {} O 0.0 {0.495524 0.28939 0.422199} O8 4037 0.0 -1 8 {} O 0.0 {0.463073 0.329803 0.42075} O9 4038 0.0 -1 8 {} O 0.0 {0.47797 0.333991 0.442732} O10 4039 0.0 -1 1 {} H 0.0 {0.483308 0.311395 0.396563} H18 4040 0.0 -1 1 {} H 0.0 {0.502902 0.326487 0.391609} H19 4041 0.0 -1 1 {} H 0.0 {0.514257 0.283879 0.363024} H20 4042 0.0 -1 1 {} H 0.0 {0.514688 0.31152 0.370983} H22 4043 0.0 -1 1 {} H 0.0 {0.494476 0.342228 0.387084} H24 4044 0.0 -1 1 {} H 0.0 {0.502658 0.287135 0.409443} H25 4045 0.0 -1 1 {} H 0.0 {0.459458 0.299297 0.442024} H26 4046 0.0 -1 1 {} H 0.0 {0.453434 0.312341 0.451122} H27 4047 0.0 -1 1 {} H 0.0 {0.46912 0.305443 0.4561} H28 4048 0.0 -1 1 {} H 0.0 {0.520062 0.30757 0.435688} H29 4049 0.0 -1 1 {} H 0.0 {0.508944 0.315948 0.444835} H31 4050 0.0 -1 1 {} H 0.0 {0.486677 0.288984 0.418794} H32 4051 0.0 -1 1 {} H 0.0 {0.467828 0.338632 0.421668} H33 4052 0.0 -1 1 {} H 0.0 {0.476214 0.341338 0.43631} H34 4053 0.0 -1 7 {} N 0.0 {0.536208 0.29285 0.381419} N3 4054 0.0 -1 1 {} H 0.0 {0.536024 0.300559 0.388238} H16 4055 0.0 -1 1 {} H 0.0 {0.534375 0.284477 0.386981} H17 4056 0.0 -1 7 {} N 0.0 {0.492579 0.269813 0.3884} N6 4057 0.0 -1 1 {} H 0.0 {0.497105 0.265122 0.380645} H41 4058 0.0 -1 1 {} H 0.0 {0.484956 0.275442 0.384207} H42 4059 0.0 -1 14 {} Si 0.0 {0.384981 0.696334 0.603041} Si6 4060 0.0 -1 8 {} O 0.0 {0.504895 0.3779 0.753325} O6 4061 0.0 -1 14 {} Si 0.0 {0.507471 0.379457 0.732823} Si7 4062 0.0 -1 8 {} O 0.0 {0.414835 0.670611 0.569893} O7 4063 0.0 -1 14 {} Si 0.0 {0.383688 0.663738 0.601062} Si8 4064 0.0 -1 7 {} N 0.0 {0.366118 0.67238 0.597709} N2 4065 0.0 -1 14 {} Si 0.0 {0.360835 0.686654 0.602466} Si9 4066 0.0 -1 14 {} Si 0.0 {0.360686 0.657457 0.598676} Si10 4067 0.0 -1 6 {} C 0.0 {0.502211 0.365728 0.74055} C3 4068 0.0 -1 7 {} N 0.0 {0.379543 0.566976 0.647695} N 4069 0.0 -1 8 {} O 0.0 {0.500235 0.393512 0.729769} O8 4070 0.0 -1 8 {} O 0.0 {0.313327 0.606879 0.595705} O9 4071 0.0 -1 8 {} O 0.0 {0.380961 0.71155 0.60292} O10 4072 0.0 -1 1 {} H 0.0 {0.389121 0.653914 0.588117} H18 4073 0.0 -1 1 {} H 0.0 {0.605558 0.680503 0.328752} H19 4074 0.0 -1 1 {} H 0.0 {0.568062 0.208643 0.390795} H20 4075 0.0 -1 1 {} H 0.0 {0.350678 0.704148 0.6108} H22 4076 0.0 -1 1 {} H 0.0 {0.671352 0.540556 0.390223} H24 4077 0.0 -1 1 {} H 0.0 {0.361794 0.648122 0.611758} H25 4078 0.0 -1 1 {} H 0.0 {0.541024 0.39659 0.763176} H26 4079 0.0 -1 1 {} H 0.0 {0.508888 0.357869 0.740099} H27 4080 0.0 -1 1 {} H 0.0 {0.492161 0.363694 0.738127} H28 4081 0.0 -1 1 {} H 0.0 {0.475877 0.246624 0.419211} H29 4082 0.0 -1 1 {} H 0.0 {0.408785 0.32564 0.739968} H31 4083 0.0 -1 1 {} H 0.0 {0.495567 0.393026 0.720974} H32 4084 0.0 -1 1 {} H 0.0 {0.409974 0.666314 0.562006} H33 4085 0.0 -1 1 {} H 0.0 {0.6073 0.616354 0.666274} H34 4086 0.0 -1 7 {} N 0.0 {0.590703 0.697776 0.340157} N3 4087 0.0 -1 1 {} H 0.0 {0.587183 0.706414 0.336088} H16 4088 0.0 -1 1 {} H 0.0 {0.600669 0.699751 0.342114} H17 4089 0.0 -1 7 {} N 0.0 {0.359412 0.648041 0.581976} N6 4090 0.0 -1 1 {} H 0.0 {0.368868 0.646358 0.578914} H41 4091 0.0 -1 1 {} H 0.0 {0.355649 0.656057 0.576743} H42 4092 0.0 -1 14 {} Si 0.0 {0.472431 0.461776 0.618375} Si6 4093 0.0 -1 8 {} O 0.0 {0.479945 0.473677 0.610767} O6 4094 0.0 -1 14 {} Si 0.0 {0.491665 0.483606 0.610085} Si7 4095 0.0 -1 8 {} O 0.0 {0.49042 0.507352 0.566848} O7 4096 0.0 -1 14 {} Si 0.0 {0.493687 0.511881 0.581337} Si8 4097 0.0 -1 7 {} N 0.0 {0.480126 0.520543 0.594037} N2 4098 0.0 -1 14 {} Si 0.0 {0.470176 0.52982 0.603622} Si9 4099 0.0 -1 14 {} Si 0.0 {0.470939 0.519826 0.579859} Si10 4100 0.0 -1 6 {} C 0.0 {0.469798 0.458328 0.636686} C3 4101 0.0 -1 7 {} N 0.0 {0.488949 0.499077 0.620665} N 4102 0.0 -1 8 {} O 0.0 {0.498508 0.486581 0.590004} O8 4103 0.0 -1 8 {} O 0.0 {0.478057 0.449866 0.607657} O9 4104 0.0 -1 8 {} O 0.0 {0.456943 0.464221 0.606351} O10 4105 0.0 -1 1 {} H 0.0 {0.460509 0.485486 0.564576} H18 4106 0.0 -1 1 {} H 0.0 {0.495597 0.497497 0.587644} H19 4107 0.0 -1 1 {} H 0.0 {0.476156 0.54306 0.607556} H20 4108 0.0 -1 1 {} H 0.0 {0.456383 0.531735 0.592014} H22 4109 0.0 -1 1 {} H 0.0 {0.47916 0.512612 0.56531} H24 4110 0.0 -1 1 {} H 0.0 {0.472069 0.536278 0.575454} H25 4111 0.0 -1 1 {} H 0.0 {0.479137 0.455276 0.640455} H26 4112 0.0 -1 1 {} H 0.0 {0.462186 0.451121 0.636872} H27 4113 0.0 -1 1 {} H 0.0 {0.46691 0.467108 0.641528} H28 4114 0.0 -1 1 {} H 0.0 {0.480038 0.498249 0.625162} H29 4115 0.0 -1 1 {} H 0.0 {0.488553 0.506635 0.61366} H31 4116 0.0 -1 1 {} H 0.0 {0.508651 0.486615 0.58926} H32 4117 0.0 -1 1 {} H 0.0 {0.477447 0.453736 0.598144} H33 4118 0.0 -1 1 {} H 0.0 {0.460385 0.46701 0.598053} H34 4119 0.0 -1 7 {} N 0.0 {0.463122 0.519394 0.617666} N3 4120 0.0 -1 1 {} H 0.0 {0.461518 0.527379 0.623909} H16 4121 0.0 -1 1 {} H 0.0 {0.47215 0.515961 0.621432} H17 4122 0.0 -1 7 {} N 0.0 {0.454051 0.509106 0.581481} N6 4123 0.0 -1 1 {} H 0.0 {0.457105 0.49955 0.580169} H41 4124 0.0 -1 1 {} H 0.0 {0.450373 0.511186 0.571984} H42 4125 0.0 -1 14 {} Si 0.0 {0.445691 0.332094 0.553988} Si6 4126 0.0 -1 8 {} O 0.0 {0.455778 0.340742 0.562931} O6 4127 0.0 -1 14 {} Si 0.0 {0.46399 0.3406 0.57679} Si7 4128 0.0 -1 8 {} O 0.0 {0.466772 0.324908 0.578431} O7 4129 0.0 -1 14 {} Si 0.0 {0.42392 0.327006 0.573864} Si8 4130 0.0 -1 7 {} N 0.0 {0.43081 0.317978 0.586393} N2 4131 0.0 -1 14 {} Si 0.0 {0.426187 0.317837 0.602364} Si9 4132 0.0 -1 14 {} Si 0.0 {0.442902 0.306941 0.587598} Si10 4133 0.0 -1 6 {} C 0.0 {0.450158 0.317238 0.545439} C3 4134 0.0 -1 7 {} N 0.0 {0.473608 0.35687 0.578764} N 4135 0.0 -1 8 {} O 0.0 {0.451134 0.3433 0.586085} O8 4136 0.0 -1 8 {} O 0.0 {0.361053 0.30795 0.511241} O9 4137 0.0 -1 8 {} O 0.0 {0.456849 0.30682 0.557807} O10 4138 0.0 -1 1 {} H 0.0 {0.416742 0.314565 0.568572} H18 4139 0.0 -1 1 {} H 0.0 {0.434132 0.32917 0.56507} H19 4140 0.0 -1 1 {} H 0.0 {0.435149 0.329333 0.610591} H20 4141 0.0 -1 1 {} H 0.0 {0.409083 0.322505 0.603719} H22 4142 0.0 -1 1 {} H 0.0 {0.446308 0.301523 0.602358} H24 4143 0.0 -1 1 {} H 0.0 {0.430225 0.342282 0.623626} H25 4144 0.0 -1 1 {} H 0.0 {0.456668 0.319991 0.538305} H26 4145 0.0 -1 1 {} H 0.0 {0.44154 0.312471 0.542137} H27 4146 0.0 -1 1 {} H 0.0 {0.286011 0.307189 0.621026} H28 4147 0.0 -1 1 {} H 0.0 {0.467193 0.361631 0.585127} H29 4148 0.0 -1 1 {} H 0.0 {0.472493 0.362635 0.570506} H31 4149 0.0 -1 1 {} H 0.0 {0.445272 0.33515 0.586663} H32 4150 0.0 -1 1 {} H 0.0 {0.4073 0.352078 0.555253} H33 4151 0.0 -1 1 {} H 0.0 {0.456255 0.298092 0.553188} H34 4152 0.0 -1 7 {} N 0.0 {0.421622 0.298698 0.609312} N3 4153 0.0 -1 1 {} H 0.0 {0.424479 0.292585 0.602306} H16 4154 0.0 -1 1 {} H 0.0 {0.429377 0.298337 0.616358} H17 4155 0.0 -1 7 {} N 0.0 {0.436855 0.290988 0.575933} N6 4156 0.0 -1 1 {} H 0.0 {0.444977 0.284879 0.57854} H41 4157 0.0 -1 1 {} H 0.0 {0.439522 0.294962 0.566603} H42 4158 0.0 -1 14 {} Si 0.0 {0.240465 0.553747 0.473485} Si6 4159 0.0 -1 8 {} O 0.0 {0.256948 0.523903 0.495063} O6 4160 0.0 -1 14 {} Si 0.0 {0.27199 0.522441 0.49907} Si7 4161 0.0 -1 8 {} O 0.0 {0.270834 0.514501 0.511935} O7 4162 0.0 -1 14 {} Si 0.0 {0.27201 0.514881 0.527888} Si8 4163 0.0 -1 7 {} N 0.0 {0.241203 0.485804 0.506128} N2 4164 0.0 -1 14 {} Si 0.0 {0.256706 0.481449 0.507759} Si9 4165 0.0 -1 14 {} Si 0.0 {0.238545 0.500588 0.502011} Si10 4166 0.0 -1 6 {} C 0.0 {0.245347 0.538222 0.469731} C3 4167 0.0 -1 7 {} N 0.0 {0.286962 0.515614 0.488447} N 4168 0.0 -1 8 {} O 0.0 {0.275819 0.537151 0.505075} O8 4169 0.0 -1 8 {} O 0.0 {0.235779 0.559953 0.488407} O9 4170 0.0 -1 8 {} O 0.0 {0.227179 0.564632 0.462273} O10 4171 0.0 -1 1 {} H 0.0 {0.289019 0.518072 0.531762} H18 4172 0.0 -1 1 {} H 0.0 {0.270422 0.501666 0.529229} H19 4173 0.0 -1 1 {} H 0.0 {0.265216 0.486177 0.493712} H20 4174 0.0 -1 1 {} H 0.0 {0.262329 0.485082 0.519628} H22 4175 0.0 -1 1 {} H 0.0 {0.225829 0.499713 0.49148} H24 4176 0.0 -1 1 {} H 0.0 {0.24901 0.5114 0.496661} H25 4177 0.0 -1 1 {} H 0.0 {0.255419 0.536187 0.472713} H26 4178 0.0 -1 1 {} H 0.0 {0.245297 0.53511 0.453622} H27 4179 0.0 -1 1 {} H 0.0 {0.238288 0.532624 0.474501} H28 4180 0.0 -1 1 {} H 0.0 {0.29192 0.524455 0.487363} H29 4181 0.0 -1 1 {} H 0.0 {0.282478 0.514419 0.479376} H31 4182 0.0 -1 1 {} H 0.0 {0.26752 0.542411 0.507086} H32 4183 0.0 -1 1 {} H 0.0 {0.24152 0.567865 0.490939} H33 4184 0.0 -1 1 {} H 0.0 {0.21843 0.56132 0.464858} H34 4185 0.0 -1 7 {} N 0.0 {0.258436 0.463412 0.504175} N3 4186 0.0 -1 1 {} H 0.0 {0.256009 0.463447 0.494649} H16 4187 0.0 -1 1 {} H 0.0 {0.249801 0.461074 0.508827} H17 4188 0.0 -1 7 {} N 0.0 {0.235581 0.509925 0.521044} N6 4189 0.0 -1 1 {} H 0.0 {0.245561 0.50714 0.522943} H41 4190 0.0 -1 1 {} H 0.0 {0.230186 0.502586 0.526909} H42 4191 0.0 -1 14 {} Si 0.0 {0.667536 0.378456 0.604047} Si6 4192 0.0 -1 8 {} O 0.0 {0.606277 0.331267 0.696032} O6 4193 0.0 -1 14 {} Si 0.0 {0.588211 0.329208 0.72481} Si7 4194 0.0 -1 8 {} O 0.0 {0.585114 0.317934 0.714208} O7 4195 0.0 -1 14 {} Si 0.0 {0.576922 0.310707 0.703611} Si8 4196 0.0 -1 7 {} N 0.0 {0.582446 0.308007 0.684574} N2 4197 0.0 -1 14 {} Si 0.0 {0.597742 0.302078 0.687356} Si9 4198 0.0 -1 14 {} Si 0.0 {0.605952 0.344086 0.704296} Si10 4199 0.0 -1 6 {} C 0.0 {0.679542 0.367109 0.601088} C3 4200 0.0 -1 7 {} N 0.0 {0.586885 0.326936 0.744527} N 4201 0.0 -1 8 {} O 0.0 {0.595358 0.337919 0.714131} O8 4202 0.0 -1 8 {} O 0.0 {0.669753 0.396344 0.615903} O9 4203 0.0 -1 8 {} O 0.0 {0.658341 0.386052 0.593557} O10 4204 0.0 -1 1 {} H 0.0 {0.653806 0.462069 0.603463} H18 4205 0.0 -1 1 {} H 0.0 {0.572249 0.330513 0.661169} H19 4206 0.0 -1 1 {} H 0.0 {0.60094 0.290721 0.693957} H20 4207 0.0 -1 1 {} H 0.0 {0.66447 0.452918 0.593817} H22 4208 0.0 -1 1 {} H 0.0 {0.619952 0.344606 0.713064} H24 4209 0.0 -1 1 {} H 0.0 {0.320538 0.349318 0.388496} H25 4210 0.0 -1 1 {} H 0.0 {0.691324 0.369038 0.614004} H26 4211 0.0 -1 1 {} H 0.0 {0.683158 0.368931 0.591708} H27 4212 0.0 -1 1 {} H 0.0 {0.675389 0.357682 0.602279} H28 4213 0.0 -1 1 {} H 0.0 {0.585516 0.335667 0.748744} H29 4214 0.0 -1 1 {} H 0.0 {0.594537 0.3224 0.749761} H31 4215 0.0 -1 1 {} H 0.0 {0.573602 0.352087 0.711252} H32 4216 0.0 -1 1 {} H 0.0 {0.674655 0.391225 0.624039} H33 4217 0.0 -1 1 {} H 0.0 {0.648849 0.386903 0.597512} H34 4218 0.0 -1 7 {} N 0.0 {0.611454 0.309346 0.675075} N3 4219 0.0 -1 1 {} H 0.0 {0.608312 0.318468 0.670989} H16 4220 0.0 -1 1 {} H 0.0 {0.620224 0.307301 0.670393} H17 4221 0.0 -1 7 {} N 0.0 {0.661436 0.454942 0.603358} N6 4222 0.0 -1 1 {} H 0.0 {0.660981 0.397928 0.618781} H41 4223 0.0 -1 1 {} H 0.0 {0.756234 0.517326 0.472271} H42 4224 0.0 -1 14 {} Si 0.0 {0.436475 0.633426 0.550314} Si6 4225 0.0 -1 8 {} O 0.0 {0.448489 0.638766 0.559516} O6 4226 0.0 -1 14 {} Si 0.0 {0.458258 0.648729 0.567113} Si7 4227 0.0 -1 8 {} O 0.0 {0.45101 0.662144 0.564268} O7 4228 0.0 -1 14 {} Si 0.0 {0.442325 0.671178 0.555626} Si8 4229 0.0 -1 7 {} N 0.0 {0.436423 0.671538 0.536389} N2 4230 0.0 -1 14 {} Si 0.0 {0.447396 0.675484 0.525642} Si9 4231 0.0 -1 14 {} Si 0.0 {0.423123 0.666078 0.528684} Si10 4232 0.0 -1 6 {} C 0.0 {0.41835 0.634857 0.555306} C3 4233 0.0 -1 7 {} N 0.0 {0.469146 0.642537 0.582766} N 4234 0.0 -1 8 {} O 0.0 {0.470149 0.652021 0.556661} O8 4235 0.0 -1 8 {} O 0.0 {0.445743 0.617895 0.544147} O9 4236 0.0 -1 8 {} O 0.0 {0.439979 0.64113 0.536394} O10 4237 0.0 -1 1 {} H 0.0 {0.426858 0.671231 0.564375} H18 4238 0.0 -1 1 {} H 0.0 {0.448419 0.68325 0.556852} H19 4239 0.0 -1 1 {} H 0.0 {0.447267 0.686033 0.511659} H20 4240 0.0 -1 1 {} H 0.0 {0.31258 0.389525 0.359831} H22 4241 0.0 -1 1 {} H 0.0 {0.416913 0.674846 0.51735} H24 4242 0.0 -1 1 {} H 0.0 {0.426484 0.653255 0.519619} H25 4243 0.0 -1 1 {} H 0.0 {0.412914 0.633214 0.546445} H26 4244 0.0 -1 1 {} H 0.0 {0.416391 0.643068 0.561689} H27 4245 0.0 -1 1 {} H 0.0 {0.416961 0.62759 0.562926} H28 4246 0.0 -1 1 {} H 0.0 {0.471303 0.632651 0.583172} H29 4247 0.0 -1 1 {} H 0.0 {0.477794 0.646789 0.579401} H31 4248 0.0 -1 1 {} H 0.0 {0.470049 0.646752 0.548695} H32 4249 0.0 -1 1 {} H 0.0 {0.455028 0.621977 0.544157} H33 4250 0.0 -1 1 {} H 0.0 {0.439386 0.651435 0.53786} H34 4251 0.0 -1 7 {} N 0.0 {0.535241 0.273077 0.667026} N3 4252 0.0 -1 1 {} H 0.0 {0.52866 0.265248 0.666945} H16 4253 0.0 -1 1 {} H 0.0 {0.458731 0.68842 0.499115} H17 4254 0.0 -1 7 {} N 0.0 {0.492618 0.61943 0.557046} N6 4255 0.0 -1 1 {} H 0.0 {0.494875 0.614213 0.565822} H41 4256 0.0 -1 1 {} H 0.0 {0.498028 0.616262 0.549072} H42 4257 0.0 -1 14 {} Si 0.0 {0.335589 0.255296 0.48438} Si6 4258 0.0 -1 8 {} O 0.0 {0.339656 0.250284 0.498946} O6 4259 0.0 -1 14 {} Si 0.0 {0.33586 0.250312 0.513669} Si7 4260 0.0 -1 8 {} O 0.0 {0.336714 0.266096 0.515346} O7 4261 0.0 -1 14 {} Si 0.0 {0.332832 0.281393 0.512977} Si8 4262 0.0 -1 7 {} N 0.0 {0.332214 0.289057 0.493857} N2 4263 0.0 -1 14 {} Si 0.0 {0.326087 0.299866 0.480996} Si9 4264 0.0 -1 14 {} Si 0.0 {0.342578 0.277575 0.489404} Si10 4265 0.0 -1 6 {} C 0.0 {0.318091 0.256117 0.477975} C3 4266 0.0 -1 7 {} N 0.0 {0.326296 0.240137 0.523911} N 4267 0.0 -1 8 {} O 0.0 {0.357028 0.250273 0.520864} O8 4268 0.0 -1 8 {} O 0.0 {0.386083 0.240869 0.519352} O9 4269 0.0 -1 8 {} O 0.0 {0.354106 0.253375 0.473466} O10 4270 0.0 -1 1 {} H 0.0 {0.340459 0.287703 0.449502} H18 4271 0.0 -1 1 {} H 0.0 {0.321765 0.285782 0.526131} H19 4272 0.0 -1 1 {} H 0.0 {0.318079 0.309836 0.489576} H20 4273 0.0 -1 1 {} H 0.0 {0.316335 0.289672 0.475385} H22 4274 0.0 -1 1 {} H 0.0 {0.351775 0.275357 0.500892} H24 4275 0.0 -1 1 {} H 0.0 {0.392975 0.293352 0.48823} H25 4276 0.0 -1 1 {} H 0.0 {0.312479 0.263913 0.482772} H26 4277 0.0 -1 1 {} H 0.0 {0.313403 0.247032 0.480925} H27 4278 0.0 -1 1 {} H 0.0 {0.317743 0.258772 0.467272} H28 4279 0.0 -1 1 {} H 0.0 {0.330639 0.239076 0.533362} H29 4280 0.0 -1 1 {} H 0.0 {0.324389 0.230789 0.52016} H31 4281 0.0 -1 1 {} H 0.0 {0.362761 0.251003 0.513137} H32 4282 0.0 -1 1 {} H 0.0 {0.388075 0.243222 0.528793} H33 4283 0.0 -1 1 {} H 0.0 {0.357276 0.262795 0.474215} H34 4284 0.0 -1 7 {} N 0.0 {0.603256 0.361894 0.698029} N3 4285 0.0 -1 1 {} H 0.0 {0.595739 0.365835 0.703321} H16 4286 0.0 -1 1 {} H 0.0 {0.600478 0.363558 0.688569} H17 4287 0.0 -1 7 {} N 0.0 {0.636983 0.325518 0.687377} N6 4288 0.0 -1 1 {} H 0.0 {0.640105 0.319139 0.695601} H41 4289 0.0 -1 1 {} H 0.0 {0.63761 0.319047 0.679028} H42 4290 0.0 -1 14 {} Si 0.0 {0.429899 0.456303 0.31578} Si6 4291 0.0 -1 8 {} O 0.0 {0.434256 0.442419 0.323276} O6 4292 0.0 -1 14 {} Si 0.0 {0.417251 0.452661 0.3357} Si7 4293 0.0 -1 8 {} O 0.0 {0.404566 0.446098 0.328176} O7 4294 0.0 -1 14 {} Si 0.0 {0.389498 0.444499 0.329725} Si8 4295 0.0 -1 7 {} N 0.0 {0.378346 0.456823 0.328726} N2 4296 0.0 -1 14 {} Si 0.0 {0.380605 0.469373 0.318558} Si9 4297 0.0 -1 14 {} Si 0.0 {0.365373 0.461925 0.337097} Si10 4298 0.0 -1 6 {} C 0.0 {0.416903 0.460333 0.302855} C3 4299 0.0 -1 7 {} N 0.0 {0.423231 0.455591 0.351842} N 4300 0.0 -1 8 {} O 0.0 {0.410638 0.473264 0.332685} O8 4301 0.0 -1 8 {} O 0.0 {0.464621 0.436862 0.286866} O9 4302 0.0 -1 8 {} O 0.0 {0.440274 0.46707 0.323255} O10 4303 0.0 -1 1 {} H 0.0 {0.383467 0.433311 0.31933} H18 4304 0.0 -1 1 {} H 0.0 {0.38602 0.440231 0.346384} H19 4305 0.0 -1 1 {} H 0.0 {0.387255 0.481258 0.326652} H20 4306 0.0 -1 1 {} H 0.0 {0.368712 0.47358 0.312689} H22 4307 0.0 -1 1 {} H 0.0 {0.355341 0.476431 0.333759} H24 4308 0.0 -1 1 {} H 0.0 {0.373394 0.463539 0.350747} H25 4309 0.0 -1 1 {} H 0.0 {0.419894 0.467919 0.296532} H26 4310 0.0 -1 1 {} H 0.0 {0.409097 0.464008 0.308927} H27 4311 0.0 -1 1 {} H 0.0 {0.413332 0.451468 0.29759} H28 4312 0.0 -1 1 {} H 0.0 {0.415749 0.45894 0.358287} H29 4313 0.0 -1 1 {} H 0.0 {0.429042 0.44807 0.356001} H31 4314 0.0 -1 1 {} H 0.0 {0.400873 0.470291 0.33368} H32 4315 0.0 -1 1 {} H 0.0 {0.470083 0.437823 0.278176} H33 4316 0.0 -1 1 {} H 0.0 {0.450121 0.464149 0.320948} H34 4317 0.0 -1 7 {} N 0.0 {0.389862 0.488699 0.299196} N3 4318 0.0 -1 1 {} H 0.0 {0.385575 0.496722 0.294733} H16 4319 0.0 -1 1 {} H 0.0 {0.398489 0.491198 0.303334} H17 4320 0.0 -1 7 {} N 0.0 {0.353223 0.446928 0.33801} N6 4321 0.0 -1 1 {} H 0.0 {0.35946 0.438711 0.340733} H41 4322 0.0 -1 1 {} H 0.0 {0.348041 0.449237 0.346406} H42 4323 0.0 -1 14 {} Si 0.0 {0.650463 0.612811 0.580915} Si6 4324 0.0 -1 8 {} O 0.0 {0.658721 0.655889 0.566665} O6 4325 0.0 -1 14 {} Si 0.0 {0.65709 0.635253 0.579133} Si7 4326 0.0 -1 8 {} O 0.0 {0.642946 0.635912 0.572376} O7 4327 0.0 -1 14 {} Si 0.0 {0.64604 0.646687 0.561546} Si8 4328 0.0 -1 7 {} N 0.0 {0.227278 0.54476 0.418124} N2 4329 0.0 -1 14 {} Si 0.0 {0.234187 0.530518 0.417088} Si9 4330 0.0 -1 14 {} Si 0.0 {0.233873 0.559021 0.42149} Si10 4331 0.0 -1 6 {} C 0.0 {0.266089 0.498651 0.377053} C3 4332 0.0 -1 7 {} N 0.0 {0.230041 0.489977 0.33305} N 4333 0.0 -1 8 {} O 0.0 {0.654111 0.617414 0.595465} O8 4334 0.0 -1 8 {} O 0.0 {0.668129 0.631101 0.567541} O9 4335 0.0 -1 8 {} O 0.0 {0.733673 0.574955 0.436997} O10 4336 0.0 -1 1 {} H 0.0 {0.651386 0.639529 0.5482} H18 4337 0.0 -1 1 {} H 0.0 {0.486351 0.510239 0.762558} H19 4338 0.0 -1 1 {} H 0.0 {0.24298 0.527164 0.405572} H20 4339 0.0 -1 1 {} H 0.0 {0.24197 0.528491 0.428274} H22 4340 0.0 -1 1 {} H 0.0 {0.624561 0.65566 0.547481} H24 4341 0.0 -1 1 {} H 0.0 {0.223102 0.570086 0.418677} H25 4342 0.0 -1 1 {} H 0.0 {0.259059 0.503907 0.382735} H26 4343 0.0 -1 1 {} H 0.0 {0.263166 0.488262 0.37707} H27 4344 0.0 -1 1 {} H 0.0 {0.276006 0.500583 0.379702} H28 4345 0.0 -1 1 {} H 0.0 {0.230892 0.492268 0.322867} H29 4346 0.0 -1 1 {} H 0.0 {0.228162 0.479696 0.333726} H31 4347 0.0 -1 1 {} H 0.0 {0.65103 0.610437 0.601172} H32 4348 0.0 -1 1 {} H 0.0 {0.665671 0.622409 0.564039} H33 4349 0.0 -1 1 {} H 0.0 {0.72209 0.578113 0.444166} H34 4350 0.0 -1 7 {} N 0.0 {0.220924 0.516534 0.416509} N3 4351 0.0 -1 1 {} H 0.0 {0.218517 0.514672 0.426521} H16 4352 0.0 -1 1 {} H 0.0 {0.212219 0.519321 0.412555} H17 4353 0.0 -1 7 {} N 0.0 {0.626806 0.658044 0.557742} N6 4354 0.0 -1 1 {} H 0.0 {0.619582 0.65469 0.564456} H41 4355 0.0 -1 1 {} H 0.0 {0.626178 0.668406 0.557305} H42 4356 0.0 -1 14 {} Si 0.0 {0.571909 0.27823 0.332973} Si6 4357 0.0 -1 8 {} O 0.0 {0.578784 0.272661 0.346308} O6 4358 0.0 -1 14 {} Si 0.0 {0.332474 0.280179 0.660053} Si7 4359 0.0 -1 8 {} O 0.0 {0.612861 0.27795 0.366873} O7 4360 0.0 -1 14 {} Si 0.0 {0.304162 0.315492 0.646971} Si8 4361 0.0 -1 7 {} N 0.0 {0.320413 0.31719 0.659044} N2 4362 0.0 -1 14 {} Si 0.0 {0.330322 0.305038 0.672091} Si9 4363 0.0 -1 14 {} Si 0.0 {0.322334 0.329779 0.643984} Si10 4364 0.0 -1 6 {} C 0.0 {0.57299 0.267991 0.316335} C3 4365 0.0 -1 7 {} N 0.0 {0.317822 0.274985 0.651257} N 4366 0.0 -1 8 {} O 0.0 {0.558543 0.303244 0.364681} O8 4367 0.0 -1 8 {} O 0.0 {0.576217 0.29332 0.333035} O9 4368 0.0 -1 8 {} O 0.0 {0.558685 0.282282 0.33997} O10 4369 0.0 -1 1 {} H 0.0 {0.29094 0.320129 0.651536} H18 4370 0.0 -1 1 {} H 0.0 {0.607562 0.280113 0.359233} H19 4371 0.0 -1 1 {} H 0.0 {0.331665 0.292656 0.666061} H20 4372 0.0 -1 1 {} H 0.0 {0.346688 0.30935 0.676192} H22 4373 0.0 -1 1 {} H 0.0 {0.320315 0.344877 0.649739} H24 4374 0.0 -1 1 {} H 0.0 {0.307784 0.327767 0.636074} H25 4375 0.0 -1 1 {} H 0.0 {0.575401 0.275447 0.309141} H26 4376 0.0 -1 1 {} H 0.0 {0.563034 0.26353 0.315046} H27 4377 0.0 -1 1 {} H 0.0 {0.573844 0.238131 0.339756} H28 4378 0.0 -1 1 {} H 0.0 {0.313424 0.26729 0.655699} H29 4379 0.0 -1 1 {} H 0.0 {0.321599 0.271175 0.64264} H31 4380 0.0 -1 1 {} H 0.0 {0.55253 0.302874 0.372882} H32 4381 0.0 -1 1 {} H 0.0 {0.579504 0.297562 0.341043} H33 4382 0.0 -1 1 {} H 0.0 {0.558567 0.288171 0.347324} H34 4383 0.0 -1 7 {} N 0.0 {0.322111 0.302992 0.685642} N3 4384 0.0 -1 1 {} H 0.0 {0.325813 0.295153 0.691423} H16 4385 0.0 -1 1 {} H 0.0 {0.599722 0.291454 0.422263} H17 4386 0.0 -1 7 {} N 0.0 {0.336703 0.326123 0.635546} N6 4387 0.0 -1 1 {} H 0.0 {0.334381 0.326816 0.625686} H41 4388 0.0 -1 1 {} H 0.0 {0.337947 0.316425 0.637015} H42 4389 0.0 -1 14 {} Si 0.0 {0.350848 0.533423 0.382832} Si6 4390 0.0 -1 8 {} O 0.0 {0.348026 0.523296 0.370779} O6 4391 0.0 -1 14 {} Si 0.0 {0.327577 0.518206 0.375673} Si7 4392 0.0 -1 8 {} O 0.0 {0.319945 0.529338 0.367672} O7 4393 0.0 -1 14 {} Si 0.0 {0.31652 0.536439 0.353726} Si8 4394 0.0 -1 7 {} N 0.0 {0.328817 0.546857 0.342957} N2 4395 0.0 -1 14 {} Si 0.0 {0.326041 0.558867 0.332677} Si9 4396 0.0 -1 14 {} Si 0.0 {0.347592 0.541874 0.34632} Si10 4397 0.0 -1 6 {} C 0.0 {0.349056 0.530192 0.401292} C3 4398 0.0 -1 7 {} N 0.0 {0.322974 0.501011 0.375457} N 4399 0.0 -1 8 {} O 0.0 {0.323507 0.523393 0.389635} O8 4400 0.0 -1 8 {} O 0.0 {0.343535 0.546509 0.377156} O9 4401 0.0 -1 8 {} O 0.0 {0.369117 0.54176 0.375627} O10 4402 0.0 -1 1 {} H 0.0 {0.309829 0.525848 0.343603} H18 4403 0.0 -1 1 {} H 0.0 {0.307215 0.54842 0.354855} H19 4404 0.0 -1 1 {} H 0.0 {0.331882 0.555446 0.319799} H20 4405 0.0 -1 1 {} H 0.0 {0.310373 0.561787 0.331045} H22 4406 0.0 -1 1 {} H 0.0 {0.375498 0.555968 0.347756} H24 4407 0.0 -1 1 {} H 0.0 {0.340142 0.529548 0.328389} H25 4408 0.0 -1 1 {} H 0.0 {0.341861 0.522822 0.403249} H26 4409 0.0 -1 1 {} H 0.0 {0.346058 0.539589 0.405596} H27 4410 0.0 -1 1 {} H 0.0 {0.358277 0.527551 0.405152} H28 4411 0.0 -1 1 {} H 0.0 {0.314855 0.497717 0.380544} H29 4412 0.0 -1 1 {} H 0.0 {0.321376 0.498824 0.365053} H31 4413 0.0 -1 1 {} H 0.0 {0.300475 0.527144 0.389474} H32 4414 0.0 -1 1 {} H 0.0 {0.333612 0.545102 0.379207} H33 4415 0.0 -1 1 {} H 0.0 {0.36538 0.548465 0.369149} H34 4416 0.0 -1 7 {} N 0.0 {0.334383 0.575247 0.334914} N3 4417 0.0 -1 1 {} H 0.0 {0.335348 0.575471 0.344806} H16 4418 0.0 -1 1 {} H 0.0 {0.343487 0.573085 0.331564} H17 4419 0.0 -1 7 {} N 0.0 {0.355198 0.558246 0.353531} N6 4420 0.0 -1 1 {} H 0.0 {0.351254 0.565398 0.347066} H41 4421 0.0 -1 1 {} H 0.0 {0.348458 0.558724 0.361335} H42 4422 0.0 -1 14 {} Si 0.0 {0.341049 0.342058 0.561823} Si6 4423 0.0 -1 8 {} O 0.0 {0.351328 0.335946 0.572012} O6 4424 0.0 -1 14 {} Si 0.0 {0.356378 0.323488 0.581397} Si7 4425 0.0 -1 8 {} O 0.0 {0.346107 0.38137 0.561664} O7 4426 0.0 -1 14 {} Si 0.0 {0.347646 0.390907 0.549521} Si8 4427 0.0 -1 7 {} N 0.0 {0.347535 0.410047 0.551736} N2 4428 0.0 -1 14 {} Si 0.0 {0.427763 0.390827 0.599985} Si9 4429 0.0 -1 14 {} Si 0.0 {0.349653 0.418123 0.566134} Si10 4430 0.0 -1 6 {} C 0.0 {0.349119 0.35366 0.541454} C3 4431 0.0 -1 7 {} N 0.0 {0.351644 0.321944 0.599251} N 4432 0.0 -1 8 {} O 0.0 {0.309573 0.313788 0.546238} O8 4433 0.0 -1 8 {} O 0.0 {0.331006 0.34974 0.571797} O9 4434 0.0 -1 8 {} O 0.0 {0.334749 0.350163 0.532561} O10 4435 0.0 -1 1 {} H 0.0 {0.345145 0.387092 0.486712} H18 4436 0.0 -1 1 {} H 0.0 {0.346676 0.396826 0.292294} H19 4437 0.0 -1 1 {} H 0.0 {0.441835 0.366493 0.609442} H20 4438 0.0 -1 1 {} H 0.0 {0.259552 0.579598 0.62618} H22 4439 0.0 -1 1 {} H 0.0 {0.338818 0.413235 0.574222} H24 4440 0.0 -1 1 {} H 0.0 {0.368651 0.370601 0.611407} H25 4441 0.0 -1 1 {} H 0.0 {0.349419 0.352105 0.55161} H26 4442 0.0 -1 1 {} H 0.0 {0.351548 0.363803 0.540391} H27 4443 0.0 -1 1 {} H 0.0 {0.357215 0.348235 0.537913} H28 4444 0.0 -1 1 {} H 0.0 {0.345219 0.314256 0.601021} H29 4445 0.0 -1 1 {} H 0.0 {0.345863 0.330188 0.600689} H31 4446 0.0 -1 1 {} H 0.0 {0.301529 0.319793 0.546108} H32 4447 0.0 -1 1 {} H 0.0 {0.332685 0.347781 0.581658} H33 4448 0.0 -1 1 {} H 0.0 {0.33514 0.340232 0.531576} H34 4449 0.0 -1 7 {} N 0.0 {0.415035 0.377645 0.609341} N3 4450 0.0 -1 1 {} H 0.0 {0.372693 0.323098 0.58324} H16 4451 0.0 -1 1 {} H 0.0 {0.407726 0.384833 0.610284} H17 4452 0.0 -1 7 {} N 0.0 {0.365235 0.409804 0.574766} N6 4453 0.0 -1 1 {} H 0.0 {0.372311 0.407493 0.567539} H41 4454 0.0 -1 1 {} H 0.0 {0.369161 0.415769 0.582086} H42 4455 0.0 -1 14 {} Si 0.0 {0.614053 0.345508 0.65613} Si6 4456 0.0 -1 8 {} O 0.0 {0.613624 0.334903 0.645371} O6 4457 0.0 -1 14 {} Si 0.0 {0.617916 0.327006 0.632735} Si7 4458 0.0 -1 8 {} O 0.0 {0.624844 0.337728 0.623825} O7 4459 0.0 -1 14 {} Si 0.0 {0.62609 0.349197 0.613401} Si8 4460 0.0 -1 7 {} N 0.0 {0.618231 0.363223 0.61015} N2 4461 0.0 -1 14 {} Si 0.0 {0.616621 0.372471 0.597142} Si9 4462 0.0 -1 14 {} Si 0.0 {0.606932 0.377254 0.619131} Si10 4463 0.0 -1 6 {} C 0.0 {0.601411 0.344845 0.669887} C3 4464 0.0 -1 7 {} N 0.0 {0.628208 0.311458 0.634174} N 4465 0.0 -1 8 {} O 0.0 {0.600837 0.326022 0.624031} O8 4466 0.0 -1 8 {} O 0.0 {0.614042 0.362059 0.64277} O9 4467 0.0 -1 8 {} O 0.0 {0.629687 0.346642 0.65758} O10 4468 0.0 -1 1 {} H 0.0 {0.642 0.356941 0.619284} H18 4469 0.0 -1 1 {} H 0.0 {0.630697 0.342119 0.601356} H19 4470 0.0 -1 1 {} H 0.0 {0.590266 0.35708 0.606177} H20 4471 0.0 -1 1 {} H 0.0 {0.604898 0.36862 0.588606} H22 4472 0.0 -1 1 {} H 0.0 {0.61386 0.390894 0.623886} H24 4473 0.0 -1 1 {} H 0.0 {0.604346 0.3621 0.638552} H25 4474 0.0 -1 1 {} H 0.0 {0.596445 0.353873 0.669216} H26 4475 0.0 -1 1 {} H 0.0 {0.60583 0.343168 0.679042} H27 4476 0.0 -1 1 {} H 0.0 {0.594093 0.337456 0.667338} H28 4477 0.0 -1 1 {} H 0.0 {0.620616 0.304726 0.635781} H29 4478 0.0 -1 1 {} H 0.0 {0.633798 0.312639 0.642153} H31 4479 0.0 -1 1 {} H 0.0 {0.599994 0.333996 0.618916} H32 4480 0.0 -1 1 {} H 0.0 {0.620054 0.356879 0.635326} H33 4481 0.0 -1 1 {} H 0.0 {0.630596 0.346326 0.667443} H34 4482 0.0 -1 7 {} N 0.0 {0.628778 0.387981 0.595461} N3 4483 0.0 -1 1 {} H 0.0 {0.624339 0.39614 0.599944} H16 4484 0.0 -1 1 {} H 0.0 {0.62859 0.391384 0.585625} H17 4485 0.0 -1 7 {} N 0.0 {0.589708 0.371365 0.626772} N6 4486 0.0 -1 1 {} H 0.0 {0.588814 0.376899 0.635138} H41 4487 0.0 -1 1 {} H 0.0 {0.58423 0.375569 0.619526} H42 4488 0.0 -1 14 {} Si 0.0 {0.590885 0.417905 0.501248} Si6 4489 0.0 -1 8 {} O 0.0 {0.605444 0.438719 0.518234} O6 4490 0.0 -1 14 {} Si 0.0 {0.593047 0.449589 0.520509} Si7 4491 0.0 -1 8 {} O 0.0 {0.599726 0.458753 0.531828} O7 4492 0.0 -1 14 {} Si 0.0 {0.610218 0.457655 0.5434} Si8 4493 0.0 -1 7 {} N 0.0 {0.614897 0.442894 0.555521} N2 4494 0.0 -1 14 {} Si 0.0 {0.615121 0.431393 0.542925} Si9 4495 0.0 -1 14 {} Si 0.0 {0.617018 0.433534 0.569231} Si10 4496 0.0 -1 6 {} C 0.0 {0.603364 0.405122 0.496728} C3 4497 0.0 -1 7 {} N 0.0 {0.586506 0.457265 0.503993} N 4498 0.0 -1 8 {} O 0.0 {0.581491 0.442488 0.52935} O8 4499 0.0 -1 8 {} O 0.0 {0.58273 0.427518 0.491372} O9 4500 0.0 -1 8 {} O 0.0 {0.579011 0.414061 0.511282} O10 4501 0.0 -1 1 {} H 0.0 {0.623664 0.46025 0.537037} H18 4502 0.0 -1 1 {} H 0.0 {0.607527 0.470532 0.554597} H19 4503 0.0 -1 1 {} H 0.0 {0.609926 0.436329 0.527416} H20 4504 0.0 -1 1 {} H 0.0 {0.606588 0.400971 0.561358} H22 4505 0.0 -1 1 {} H 0.0 {0.632258 0.434613 0.574078} H24 4506 0.0 -1 1 {} H 0.0 {0.612863 0.419601 0.568228} H25 4507 0.0 -1 1 {} H 0.0 {0.600847 0.396385 0.50303} H26 4508 0.0 -1 1 {} H 0.0 {0.612941 0.409292 0.499314} H27 4509 0.0 -1 1 {} H 0.0 {0.600921 0.401984 0.486353} H28 4510 0.0 -1 1 {} H 0.0 {0.58711 0.46694 0.506245} H29 4511 0.0 -1 1 {} H 0.0 {0.594125 0.454616 0.498276} H31 4512 0.0 -1 1 {} H 0.0 {0.578436 0.434697 0.524457} H32 4513 0.0 -1 1 {} H 0.0 {0.59 0.432444 0.486811} H33 4514 0.0 -1 1 {} H 0.0 {0.571729 0.420854 0.509798} H34 4515 0.0 -1 7 {} N 0.0 {0.632799 0.424385 0.538678} N3 4516 0.0 -1 1 {} H 0.0 {0.630773 0.417842 0.531504} H16 4517 0.0 -1 1 {} H 0.0 {0.635249 0.418935 0.546842} H17 4518 0.0 -1 7 {} N 0.0 {0.606422 0.441315 0.583527} N6 4519 0.0 -1 1 {} H 0.0 {0.603165 0.450357 0.581198} H41 4520 0.0 -1 1 {} H 0.0 {0.598651 0.434618 0.583643} H42 4521 0.0 -1 14 {} Si 0.0 {0.316606 0.338921 0.461585} Si6 4522 0.0 -1 8 {} O 0.0 {0.332833 0.350297 0.460867} O6 4523 0.0 -1 14 {} Si 0.0 {0.636371 0.580592 0.610495} Si7 4524 0.0 -1 8 {} O 0.0 {0.62927 0.571976 0.621467} O7 4525 0.0 -1 14 {} Si 0.0 {0.621694 0.56028 0.628626} Si8 4526 0.0 -1 7 {} N 0.0 {0.350228 0.366503 0.411885} N2 4527 0.0 -1 14 {} Si 0.0 {0.608723 0.580236 0.576856} Si9 4528 0.0 -1 14 {} Si 0.0 {0.339732 0.366644 0.424068} Si10 4529 0.0 -1 6 {} C 0.0 {0.300302 0.344033 0.462549} C3 4530 0.0 -1 7 {} N 0.0 {0.633386 0.597011 0.606399} N 4531 0.0 -1 8 {} O 0.0 {0.60747 0.562549 0.622927} O8 4532 0.0 -1 8 {} O 0.0 {0.299576 0.358908 0.453455} O9 4533 0.0 -1 8 {} O 0.0 {0.31992 0.3257 0.445923} O10 4534 0.0 -1 1 {} H 0.0 {0.618215 0.56394 0.645918} H18 4535 0.0 -1 1 {} H 0.0 {0.642394 0.691696 0.448573} H19 4536 0.0 -1 1 {} H 0.0 {0.61101 0.570109 0.566255} H20 4537 0.0 -1 1 {} H 0.0 {0.608878 0.564121 0.591539} H22 4538 0.0 -1 1 {} H 0.0 {0.340264 0.350982 0.430291} H24 4539 0.0 -1 1 {} H 0.0 {0.644244 0.54853 0.637919} H25 4540 0.0 -1 1 {} H 0.0 {0.293643 0.336888 0.459138} H26 4541 0.0 -1 1 {} H 0.0 {0.298472 0.347068 0.472563} H27 4542 0.0 -1 1 {} H 0.0 {0.291125 0.355153 0.491591} H28 4543 0.0 -1 1 {} H 0.0 {0.628081 0.597629 0.597508} H29 4544 0.0 -1 1 {} H 0.0 {0.628314 0.602124 0.613263} H31 4545 0.0 -1 1 {} H 0.0 {0.368554 0.22301 0.4885} H32 4546 0.0 -1 1 {} H 0.0 {0.308425 0.362146 0.455929} H33 4547 0.0 -1 1 {} H 0.0 {0.323231 0.331422 0.438885} H34 4548 0.0 -1 7 {} N 0.0 {0.612426 0.598675 0.570127} N3 4549 0.0 -1 1 {} H 0.0 {0.604013 0.602481 0.5655} H16 4550 0.0 -1 1 {} H 0.0 {0.619314 0.595459 0.563049} H17 4551 0.0 -1 7 {} N 0.0 {0.320701 0.367924 0.422229} N6 4552 0.0 -1 1 {} H 0.0 {0.317874 0.362926 0.430726} H41 4553 0.0 -1 1 {} H 0.0 {0.31896 0.361538 0.414637} H42 4554 0.0 -1 14 {} Si 0.0 {0.539882 0.27517 0.648541} Si6 4555 0.0 -1 8 {} O 0.0 {0.530509 0.26479 0.641497} O6 4556 0.0 -1 14 {} Si 0.0 {0.533463 0.252726 0.63165} Si7 4557 0.0 -1 8 {} O 0.0 {0.426718 0.64338 0.507933} O7 4558 0.0 -1 14 {} Si 0.0 {0.411488 0.643245 0.503412} Si8 4559 0.0 -1 7 {} N 0.0 {0.400548 0.631638 0.506787} N2 4560 0.0 -1 14 {} Si 0.0 {0.409183 0.620073 0.51504} Si9 4561 0.0 -1 14 {} Si 0.0 {0.384967 0.625016 0.510738} Si10 4562 0.0 -1 6 {} C 0.0 {0.558589 0.272981 0.651421} C3 4563 0.0 -1 7 {} N 0.0 {0.25699 0.560075 0.618244} N 4564 0.0 -1 8 {} O 0.0 {0.545611 0.258243 0.621076} O8 4565 0.0 -1 8 {} O 0.0 {0.447946 0.689008 0.500245} O9 4566 0.0 -1 8 {} O 0.0 {0.532576 0.289626 0.639361} O10 4567 0.0 -1 1 {} H 0.0 {0.403924 0.657667 0.50994} H18 4568 0.0 -1 1 {} H 0.0 {0.418271 0.648799 0.475653} H19 4569 0.0 -1 1 {} H 0.0 {0.411204 0.624457 0.528907} H20 4570 0.0 -1 1 {} H 0.0 {0.436074 0.511569 0.47923} H22 4571 0.0 -1 1 {} H 0.0 {0.38445 0.615515 0.524708} H24 4572 0.0 -1 1 {} H 0.0 {0.377892 0.616087 0.501915} H25 4573 0.0 -1 1 {} H 0.0 {0.560803 0.271906 0.662229} H26 4574 0.0 -1 1 {} H 0.0 {0.564062 0.280971 0.647818} H27 4575 0.0 -1 1 {} H 0.0 {0.559743 0.263787 0.646232} H28 4576 0.0 -1 1 {} H 0.0 {0.249198 0.554737 0.613723} H29 4577 0.0 -1 1 {} H 0.0 {0.264371 0.556498 0.612983} H31 4578 0.0 -1 1 {} H 0.0 {0.541834 0.256308 0.6126} H32 4579 0.0 -1 1 {} H 0.0 {0.402943 0.947854 0.995923} H33 4580 0.0 -1 1 {} H 0.0 {0.532831 0.287756 0.629319} H34 4581 0.0 -1 7 {} N 0.0 {0.420484 0.606276 0.506032} N3 4582 0.0 -1 1 {} H 0.0 {0.417747 0.596258 0.507893} H16 4583 0.0 -1 1 {} H 0.0 {0.421367 0.607901 0.495763} H17 4584 0.0 -1 7 {} N 0.0 {0.375901 0.640435 0.51778} N6 4585 0.0 -1 1 {} H 0.0 {0.366273 0.638567 0.515338} H41 4586 0.0 -1 1 {} H 0.0 {0.379515 0.647348 0.51089} H42 4587 0.0 -1 14 {} Si 0.0 {0.342006 0.407502 0.377895} Si6 4588 0.0 -1 8 {} O 0.0 {0.356028 0.401733 0.380809} O6 4589 0.0 -1 14 {} Si 0.0 {0.370317 0.400501 0.372592} Si7 4590 0.0 -1 8 {} O 0.0 {0.365421 0.406784 0.35952} O7 4591 0.0 -1 14 {} Si 0.0 {0.345978 0.402281 0.351758} Si8 4592 0.0 -1 7 {} N 0.0 {0.675335 0.534122 0.505615} N2 4593 0.0 -1 14 {} Si 0.0 {0.683034 0.548226 0.5035} Si9 4594 0.0 -1 14 {} Si 0.0 {0.673 0.532521 0.485489} Si10 4595 0.0 -1 6 {} C 0.0 {0.664559 0.516022 0.486521} C3 4596 0.0 -1 7 {} N 0.0 {0.633807 0.52826 0.480779} N 4597 0.0 -1 8 {} O 0.0 {0.694181 0.552132 0.494349} O8 4598 0.0 -1 8 {} O 0.0 {0.327623 0.407863 0.403191} O9 4599 0.0 -1 8 {} O 0.0 {0.369096 0.385065 0.368251} O10 4600 0.0 -1 1 {} H 0.0 {0.361563 0.408761 0.336063} H18 4601 0.0 -1 1 {} H 0.0 {0.3424 0.387558 0.360878} H19 4602 0.0 -1 1 {} H 0.0 {0.632999 0.531084 0.490941} H20 4603 0.0 -1 1 {} H 0.0 {0.690647 0.559625 0.489023} H22 4604 0.0 -1 1 {} H 0.0 {0.451047 0.392318 0.309588} H24 4605 0.0 -1 1 {} H 0.0 {0.641496 0.555252 0.446062} H25 4606 0.0 -1 1 {} H 0.0 {0.654134 0.516764 0.483084} H26 4607 0.0 -1 1 {} H 0.0 {0.669689 0.508779 0.48023} H27 4608 0.0 -1 1 {} H 0.0 {0.663948 0.512084 0.496851} H28 4609 0.0 -1 1 {} H 0.0 {0.637952 0.536912 0.47682} H29 4610 0.0 -1 1 {} H 0.0 {0.624309 0.529057 0.477362} H31 4611 0.0 -1 1 {} H 0.0 {0.298115 0.481588 0.31318} H32 4612 0.0 -1 1 {} H 0.0 {0.333535 0.407571 0.392049} H33 4613 0.0 -1 1 {} H 0.0 {0.31549 0.386456 0.40047} H34 4614 0.0 -1 7 {} N 0.0 {0.673513 0.56295 0.513469} N3 4615 0.0 -1 1 {} H 0.0 {0.663557 0.559875 0.513682} H16 4616 0.0 -1 1 {} H 0.0 {0.680999 0.564426 0.519739} H17 4617 0.0 -1 7 {} N 0.0 {0.660466 0.5461 0.480036} N6 4618 0.0 -1 1 {} H 0.0 {0.655274 0.545545 0.48861} H41 4619 0.0 -1 1 {} H 0.0 {0.667057 0.554035 0.478827} H42 4620 0.0 -1 14 {} Si 0.0 {0.564129 0.464607 0.565525} Si6 4621 0.0 -1 8 {} O 0.0 {0.564771 0.478201 0.558089} O6 4622 0.0 -1 14 {} Si 0.0 {0.57232 0.4916 0.554397} Si7 4623 0.0 -1 8 {} O 0.0 {0.56575 0.49922 0.566317} O7 4624 0.0 -1 14 {} Si 0.0 {0.554135 0.497418 0.576232} Si8 4625 0.0 -1 7 {} N 0.0 {0.554682 0.509612 0.591431} N2 4626 0.0 -1 14 {} Si 0.0 {0.568057 0.508758 0.60092} Si9 4627 0.0 -1 14 {} Si 0.0 {0.541019 0.515626 0.598082} Si10 4628 0.0 -1 6 {} C 0.0 {0.58068 0.449534 0.56191} C3 4629 0.0 -1 7 {} N 0.0 {0.587389 0.49754 0.546764} N 4630 0.0 -1 8 {} O 0.0 {0.560323 0.503177 0.530645} O8 4631 0.0 -1 8 {} O 0.0 {0.552003 0.468835 0.583027} O9 4632 0.0 -1 8 {} O 0.0 {0.578012 0.463131 0.573747} O10 4633 0.0 -1 1 {} H 0.0 {0.542345 0.50072 0.569129} H18 4634 0.0 -1 1 {} H 0.0 {0.552306 0.481457 0.580425} H19 4635 0.0 -1 1 {} H 0.0 {0.57271 0.522928 0.6069} H20 4636 0.0 -1 1 {} H 0.0 {0.565675 0.499889 0.614734} H22 4637 0.0 -1 1 {} H 0.0 {0.539166 0.530539 0.591828} H24 4638 0.0 -1 1 {} H 0.0 {0.545458 0.519108 0.613164} H25 4639 0.0 -1 1 {} H 0.0 {0.577146 0.449401 0.55229} H26 4640 0.0 -1 1 {} H 0.0 {0.578037 0.43994 0.565785} H27 4641 0.0 -1 1 {} H 0.0 {0.591266 0.449821 0.56233} H28 4642 0.0 -1 1 {} H 0.0 {0.588809 0.507399 0.54805} H29 4643 0.0 -1 1 {} H 0.0 {0.589064 0.496268 0.53662} H31 4644 0.0 -1 1 {} H 0.0 {0.564041 0.497508 0.540478} H32 4645 0.0 -1 1 {} H 0.0 {0.558257 0.467481 0.590408} H33 4646 0.0 -1 1 {} H 0.0 {0.5842 0.470275 0.570092} H34 4647 0.0 -1 7 {} N 0.0 {0.58054 0.494702 0.594563} N3 4648 0.0 -1 1 {} H 0.0 {0.575696 0.48709 0.59941} H16 4649 0.0 -1 1 {} H 0.0 {0.577302 0.495199 0.584928} H17 4650 0.0 -1 7 {} N 0.0 {0.525299 0.503807 0.59669} N6 4651 0.0 -1 1 {} H 0.0 {0.523076 0.505368 0.586978} H41 4652 0.0 -1 1 {} H 0.0 {0.518305 0.509083 0.601566} H42 4653 0.0 -1 14 {} Si 0.0 {0.357387 0.622391 0.631475} Si6 4654 0.0 -1 8 {} O 0.0 {0.341927 0.626284 0.632295} O6 4655 0.0 -1 14 {} Si 0.0 {0.3269 0.622777 0.626876} Si7 4656 0.0 -1 8 {} O 0.0 {0.326309 0.607223 0.624695} O7 4657 0.0 -1 14 {} Si 0.0 {0.334597 0.59429 0.62158} Si8 4658 0.0 -1 7 {} N 0.0 {0.330611 0.579282 0.623013} N2 4659 0.0 -1 14 {} Si 0.0 {0.358102 0.689074 0.62792} Si9 4660 0.0 -1 14 {} Si 0.0 {0.323652 0.567453 0.614583} Si10 4661 0.0 -1 6 {} C 0.0 {0.36612 0.606038 0.631483} C3 4662 0.0 -1 7 {} N 0.0 {0.31381 0.634196 0.635734} N 4663 0.0 -1 8 {} O 0.0 {0.380525 0.606339 0.607214} O8 4664 0.0 -1 8 {} O 0.0 {0.341621 0.633908 0.657806} O9 4665 0.0 -1 8 {} O 0.0 {0.361714 0.636932 0.625263} O10 4666 0.0 -1 1 {} H 0.0 {0.580454 0.425245 0.791462} H18 4667 0.0 -1 1 {} H 0.0 {0.386815 0.603562 0.614625} H19 4668 0.0 -1 1 {} H 0.0 {0.279584 0.604136 0.26499} H20 4669 0.0 -1 1 {} H 0.0 {0.757949 0.499191 0.481069} H22 4670 0.0 -1 1 {} H 0.0 {0.334052 0.550112 0.623746} H24 4671 0.0 -1 1 {} H 0.0 {0.320312 0.572163 0.603034} H25 4672 0.0 -1 1 {} H 0.0 {0.377061 0.6081 0.632525} H26 4673 0.0 -1 1 {} H 0.0 {0.363573 0.601813 0.621573} H27 4674 0.0 -1 1 {} H 0.0 {0.361527 0.599738 0.638716} H28 4675 0.0 -1 1 {} H 0.0 {0.307246 0.635613 0.628141} H29 4676 0.0 -1 1 {} H 0.0 {0.310586 0.627827 0.642366} H31 4677 0.0 -1 1 {} H 0.0 {0.380857 0.596882 0.604285} H32 4678 0.0 -1 1 {} H 0.0 {0.438605 0.581312 0.597429} H33 4679 0.0 -1 1 {} H 0.0 {0.624089 0.48434 0.664713} H34 4680 0.0 -1 7 {} N 0.0 {0.395915 0.703495 0.643324} N3 4681 0.0 -1 1 {} H 0.0 {0.389553 0.709839 0.647727} H16 4682 0.0 -1 1 {} H 0.0 {0.398012 0.695954 0.650226} H17 4683 0.0 -1 7 {} N 0.0 {0.306908 0.561158 0.621343} N6 4684 0.0 -1 1 {} H 0.0 {0.301516 0.566899 0.614975} H41 4685 0.0 -1 1 {} H 0.0 {0.305771 0.565412 0.630499} H42 4686 0.0 -1 14 {} Si 0.0 {0.432781 0.455294 0.268683} Si6 4687 0.0 -1 8 {} O 0.0 {0.440535 0.455865 0.282288} O6 4688 0.0 -1 14 {} Si 0.0 {0.211103 0.521159 0.589317} Si7 4689 0.0 -1 8 {} O 0.0 {0.223633 0.52623 0.597671} O7 4690 0.0 -1 14 {} Si 0.0 {0.210533 0.543144 0.57685} Si8 4691 0.0 -1 7 {} N 0.0 {0.22172 0.549945 0.567899} N2 4692 0.0 -1 14 {} Si 0.0 {0.237225 0.553393 0.555632} Si9 4693 0.0 -1 14 {} Si 0.0 {0.235292 0.546582 0.581151} Si10 4694 0.0 -1 6 {} C 0.0 {0.425499 0.44078 0.262985} C3 4695 0.0 -1 7 {} N 0.0 {0.213987 0.509775 0.574193} N 4696 0.0 -1 8 {} O 0.0 {0.196391 0.529063 0.596266} O8 4697 0.0 -1 8 {} O 0.0 {0.442361 0.466079 0.260948} O9 4698 0.0 -1 8 {} O 0.0 {0.207523 0.489363 0.664359} O10 4699 0.0 -1 1 {} H 0.0 {0.198982 0.541742 0.567641} H18 4700 0.0 -1 1 {} H 0.0 {0.204634 0.552536 0.587845} H19 4701 0.0 -1 1 {} H 0.0 {0.24961 0.560862 0.561342} H20 4702 0.0 -1 1 {} H 0.0 {0.242184 0.540409 0.548266} H22 4703 0.0 -1 1 {} H 0.0 {0.250022 0.541194 0.576361} H24 4704 0.0 -1 1 {} H 0.0 {0.228532 0.534585 0.591439} H25 4705 0.0 -1 1 {} H 0.0 {0.415939 0.442611 0.258068} H26 4706 0.0 -1 1 {} H 0.0 {0.443451 0.464964 0.284884} H27 4707 0.0 -1 1 {} H 0.0 {0.401612 0.426946 0.235127} H28 4708 0.0 -1 1 {} H 0.0 {0.218889 0.501877 0.578572} H29 4709 0.0 -1 1 {} H 0.0 {0.220039 0.514416 0.567778} H31 4710 0.0 -1 1 {} H 0.0 {0.199352 0.538279 0.599824} H32 4711 0.0 -1 1 {} H 0.0 {0.441368 0.475151 0.265311} H33 4712 0.0 -1 1 {} H 0.0 {0.211985 0.499608 0.660848} H34 4713 0.0 -1 7 {} N 0.0 {0.227468 0.565579 0.543579} N3 4714 0.0 -1 1 {} H 0.0 {0.234237 0.572974 0.546424} H16 4715 0.0 -1 1 {} H 0.0 {0.220198 0.567102 0.550293} H17 4716 0.0 -1 7 {} N 0.0 {0.235742 0.558912 0.593554} N6 4717 0.0 -1 1 {} H 0.0 {0.228271 0.565092 0.59127} H41 4718 0.0 -1 1 {} H 0.0 {0.244998 0.562548 0.591552} H42 4719 0.0 -1 14 {} Si 0.0 {0.610265 0.455618 0.412127} Si6 4720 0.0 -1 8 {} O 0.0 {0.615274 0.45928 0.426575} O6 4721 0.0 -1 14 {} Si 0.0 {0.61603 0.467454 0.440153} Si7 4722 0.0 -1 8 {} O 0.0 {0.605108 0.46087 0.448538} O7 4723 0.0 -1 14 {} Si 0.0 {0.592616 0.451212 0.450481} Si8 4724 0.0 -1 7 {} N 0.0 {0.581179 0.446629 0.439465} N2 4725 0.0 -1 14 {} Si 0.0 {0.579533 0.458889 0.427971} Si9 4726 0.0 -1 14 {} Si 0.0 {0.570252 0.436082 0.433155} Si10 4727 0.0 -1 6 {} C 0.0 {0.594058 0.45878 0.408076} C3 4728 0.0 -1 7 {} N 0.0 {0.631511 0.494012 0.464413} N 4729 0.0 -1 8 {} O 0.0 {0.609222 0.480759 0.436384} O8 4730 0.0 -1 8 {} O 0.0 {0.619028 0.438533 0.411722} O9 4731 0.0 -1 8 {} O 0.0 {0.625831 0.465721 0.40157} O10 4732 0.0 -1 1 {} H 0.0 {0.600053 0.435974 0.455467} H18 4733 0.0 -1 1 {} H 0.0 {0.583112 0.4582 0.463898} H19 4734 0.0 -1 1 {} H 0.0 {0.564223 0.454926 0.417199} H20 4735 0.0 -1 1 {} H 0.0 {0.555246 0.437641 0.434237} H22 4736 0.0 -1 1 {} H 0.0 {0.600318 0.389043 0.444337} H24 4737 0.0 -1 1 {} H 0.0 {0.575758 0.424912 0.445822} H25 4738 0.0 -1 1 {} H 0.0 {0.590295 0.450103 0.402961} H26 4739 0.0 -1 1 {} H 0.0 {0.594671 0.468402 0.402878} H27 4740 0.0 -1 1 {} H 0.0 {0.580244 0.472945 0.474989} H28 4741 0.0 -1 1 {} H 0.0 {0.623678 0.499904 0.461483} H29 4742 0.0 -1 1 {} H 0.0 {0.631191 0.49436 0.474715} H31 4743 0.0 -1 1 {} H 0.0 {0.632131 0.458726 0.400451} H32 4744 0.0 -1 1 {} H 0.0 {0.613684 0.432441 0.417733} H33 4745 0.0 -1 1 {} H 0.0 {0.6298 0.472125 0.408404} H34 4746 0.0 -1 7 {} N 0.0 {0.56728 0.473462 0.431889} N3 4747 0.0 -1 1 {} H 0.0 {0.562179 0.468108 0.439173} H16 4748 0.0 -1 1 {} H 0.0 {0.574241 0.479243 0.436966} H17 4749 0.0 -1 7 {} N 0.0 {0.576318 0.426494 0.416531} N6 4750 0.0 -1 1 {} H 0.0 {0.583493 0.432061 0.411777} H41 4751 0.0 -1 1 {} H 0.0 {0.567217 0.428191 0.411876} H42 4752 0.0 -1 14 {} Si 0.0 {0.328014 0.277181 0.617185} Si6 4753 0.0 -1 8 {} O 0.0 {0.343708 0.272602 0.618267} O6 4754 0.0 -1 14 {} Si 0.0 {0.356498 0.269064 0.608901} Si7 4755 0.0 -1 8 {} O 0.0 {0.353577 0.251598 0.607933} O7 4756 0.0 -1 14 {} Si 0.0 {0.244257 0.659326 0.544403} Si8 4757 0.0 -1 7 {} N 0.0 {0.230806 0.654543 0.551818} N2 4758 0.0 -1 14 {} Si 0.0 {0.221878 0.65157 0.538674} Si9 4759 0.0 -1 14 {} Si 0.0 {0.219565 0.650112 0.563388} Si10 4760 0.0 -1 6 {} C 0.0 {0.32266 0.293814 0.617084} C3 4761 0.0 -1 7 {} N 0.0 {0.360357 0.275755 0.59306} N 4762 0.0 -1 8 {} O 0.0 {0.367844 0.270071 0.620772} O8 4763 0.0 -1 8 {} O 0.0 {0.320858 0.263081 0.622558} O9 4764 0.0 -1 8 {} O 0.0 {0.360784 0.344104 0.641035} O10 4765 0.0 -1 1 {} H 0.0 {0.240294 0.666416 0.530032} H18 4766 0.0 -1 1 {} H 0.0 {0.255196 0.647415 0.54255} H19 4767 0.0 -1 1 {} H 0.0 {0.577903 0.68368 0.395591} H20 4768 0.0 -1 1 {} H 0.0 {0.355248 0.248969 0.598614} H22 4769 0.0 -1 1 {} H 0.0 {0.205164 0.645511 0.558027} H24 4770 0.0 -1 1 {} H 0.0 {0.213716 0.662081 0.571666} H25 4771 0.0 -1 1 {} H 0.0 {0.602158 0.650542 0.527063} H26 4772 0.0 -1 1 {} H 0.0 {0.320687 0.297231 0.606759} H27 4773 0.0 -1 1 {} H 0.0 {0.329888 0.299522 0.622318} H28 4774 0.0 -1 1 {} H 0.0 {0.363813 0.285802 0.592461} H29 4775 0.0 -1 1 {} H 0.0 {0.351922 0.275691 0.586682} H31 4776 0.0 -1 1 {} H 0.0 {0.616902 0.64712 0.531064} H32 4777 0.0 -1 1 {} H 0.0 {0.328334 0.258103 0.625516} H33 4778 0.0 -1 1 {} H 0.0 {0.359021 0.346123 0.650832} H34 4779 0.0 -1 7 {} N 0.0 {0.477063 0.583343 0.558808} N3 4780 0.0 -1 1 {} H 0.0 {0.483133 0.581828 0.550412} H16 4781 0.0 -1 1 {} H 0.0 {0.274831 0.455688 0.537546} H17 4782 0.0 -1 7 {} N 0.0 {0.226779 0.634986 0.574907} N6 4783 0.0 -1 1 {} H 0.0 {0.23348 0.641627 0.578816} H41 4784 0.0 -1 1 {} H 0.0 {0.231352 0.630479 0.567433} H42 4785 0.0 -1 14 {} Si 0.0 {0.495724 0.710053 0.499868} Si6 4786 0.0 -1 8 {} O 0.0 {0.487542 0.72059 0.50934} O6 4787 0.0 -1 14 {} Si 0.0 {0.508052 0.68939 0.520766} Si7 4788 0.0 -1 8 {} O 0.0 {0.516001 0.697497 0.531152} O7 4789 0.0 -1 14 {} Si 0.0 {0.520375 0.711405 0.535934} Si8 4790 0.0 -1 7 {} N 0.0 {0.51275 0.726224 0.53587} N2 4791 0.0 -1 14 {} Si 0.0 {0.514334 0.741785 0.531334} Si9 4792 0.0 -1 14 {} Si 0.0 {0.496678 0.722354 0.534362} Si10 4793 0.0 -1 6 {} C 0.0 {0.490839 0.702864 0.484793} C3 4794 0.0 -1 7 {} N 0.0 {0.496251 0.677813 0.526277} N 4795 0.0 -1 8 {} O 0.0 {0.526552 0.683751 0.513598} O8 4796 0.0 -1 8 {} O 0.0 {0.5011 0.701189 0.512075} O9 4797 0.0 -1 8 {} O 0.0 {0.512995 0.722418 0.501368} O10 4798 0.0 -1 1 {} H 0.0 {0.558659 0.712436 0.50931} H18 4799 0.0 -1 1 {} H 0.0 {0.460261 0.695997 0.538209} H19 4800 0.0 -1 1 {} H 0.0 {0.513822 0.746818 0.546734} H20 4801 0.0 -1 1 {} H 0.0 {0.494178 0.743674 0.514349} H22 4802 0.0 -1 1 {} H 0.0 {0.488055 0.706486 0.541375} H24 4803 0.0 -1 1 {} H 0.0 {0.492034 0.721609 0.518446} H25 4804 0.0 -1 1 {} H 0.0 {0.557165 0.295626 0.688223} H26 4805 0.0 -1 1 {} H 0.0 {0.48051 0.705955 0.482906} H27 4806 0.0 -1 1 {} H 0.0 {0.49695 0.706634 0.477218} H28 4807 0.0 -1 1 {} H 0.0 {0.492586 0.673457 0.517634} H29 4808 0.0 -1 1 {} H 0.0 {0.500757 0.669883 0.530796} H31 4809 0.0 -1 1 {} H 0.0 {0.531205 0.684026 0.52243} H32 4810 0.0 -1 1 {} H 0.0 {0.529961 0.281766 0.669777} H33 4811 0.0 -1 1 {} H 0.0 {0.513222 0.724687 0.510691} H34 4812 0.0 -1 7 {} N 0.0 {0.532886 0.742689 0.523595} N3 4813 0.0 -1 1 {} H 0.0 {0.530186 0.746458 0.514545} H16 4814 0.0 -1 1 {} H 0.0 {0.536134 0.733344 0.521135} H17 4815 0.0 -1 7 {} N 0.0 {0.484573 0.731009 0.54656} N6 4816 0.0 -1 1 {} H 0.0 {0.47574 0.726458 0.543278} H41 4817 0.0 -1 1 {} H 0.0 {0.484778 0.740174 0.541871} H42 4818 0.0 -1 14 {} Si 0.0 {0.422709 0.447883 0.523468} Si6 4819 0.0 -1 8 {} O 0.0 {0.431137 0.435353 0.526652} O6 4820 0.0 -1 14 {} Si 0.0 {0.436599 0.422717 0.533813} Si7 4821 0.0 -1 8 {} O 0.0 {0.425171 0.412021 0.531936} O7 4822 0.0 -1 14 {} Si 0.0 {0.41278 0.41008 0.522624} Si8 4823 0.0 -1 7 {} N 0.0 {0.413531 0.403068 0.506953} N2 4824 0.0 -1 14 {} Si 0.0 {0.415218 0.40677 0.490402} Si9 4825 0.0 -1 14 {} Si 0.0 {0.406262 0.385768 0.504902} Si10 4826 0.0 -1 6 {} C 0.0 {0.430614 0.464499 0.519321} C3 4827 0.0 -1 7 {} N 0.0 {0.454831 0.417464 0.528705} N 4828 0.0 -1 8 {} O 0.0 {0.43292 0.423389 0.554164} O8 4829 0.0 -1 8 {} O 0.0 {0.413165 0.448236 0.536536} O9 4830 0.0 -1 8 {} O 0.0 {0.408104 0.439154 0.512358} O10 4831 0.0 -1 1 {} H 0.0 {0.402797 0.402868 0.529873} H18 4832 0.0 -1 1 {} H 0.0 {0.409522 0.42701 0.517084} H19 4833 0.0 -1 1 {} H 0.0 {0.409565 0.397326 0.479675} H20 4834 0.0 -1 1 {} H 0.0 {0.406172 0.417234 0.491124} H22 4835 0.0 -1 1 {} H 0.0 {0.40176 0.385889 0.490785} H24 4836 0.0 -1 1 {} H 0.0 {0.395821 0.383097 0.516629} H25 4837 0.0 -1 1 {} H 0.0 {0.423869 0.472102 0.519943} H26 4838 0.0 -1 1 {} H 0.0 {0.434897 0.462972 0.510347} H27 4839 0.0 -1 1 {} H 0.0 {0.438735 0.467644 0.526397} H28 4840 0.0 -1 1 {} H 0.0 {0.459393 0.426693 0.529649} H29 4841 0.0 -1 1 {} H 0.0 {0.452254 0.417008 0.518878} H31 4842 0.0 -1 1 {} H 0.0 {0.42413 0.419463 0.554162} H32 4843 0.0 -1 1 {} H 0.0 {0.415246 0.455781 0.541753} H33 4844 0.0 -1 1 {} H 0.0 {0.400591 0.4424 0.518126} H34 4845 0.0 -1 7 {} N 0.0 {0.434178 0.410269 0.485064} N3 4846 0.0 -1 1 {} H 0.0 {0.44039 0.408709 0.493517} H16 4847 0.0 -1 1 {} H 0.0 {0.434911 0.419765 0.481655} H17 4848 0.0 -1 7 {} N 0.0 {0.419447 0.372018 0.5078} N6 4849 0.0 -1 1 {} H 0.0 {0.423861 0.373731 0.498845} H41 4850 0.0 -1 1 {} H 0.0 {0.425729 0.376807 0.514896} H42 4851 0.0 -1 14 {} Si 0.0 {0.601095 0.424971 0.657159} Si6 4852 0.0 -1 8 {} O 0.0 {0.597673 0.41045 0.651079} O6 4853 0.0 -1 14 {} Si 0.0 {0.588585 0.397704 0.652882} Si7 4854 0.0 -1 8 {} O 0.0 {0.582035 0.399275 0.638775} O7 4855 0.0 -1 14 {} Si 0.0 {0.569622 0.407379 0.632959} Si8 4856 0.0 -1 7 {} N 0.0 {0.56964 0.424729 0.626101} N2 4857 0.0 -1 14 {} Si 0.0 {0.561407 0.431205 0.612419} Si9 4858 0.0 -1 14 {} Si 0.0 {0.572772 0.438895 0.63396} Si10 4859 0.0 -1 6 {} C 0.0 {0.616609 0.425298 0.667643} C3 4860 0.0 -1 7 {} N 0.0 {0.593163 0.380337 0.660536} N 4861 0.0 -1 8 {} O 0.0 {0.573604 0.403743 0.664704} O8 4862 0.0 -1 8 {} O 0.0 {0.587389 0.4304 0.663345} O9 4863 0.0 -1 8 {} O 0.0 {0.600987 0.432531 0.638086} O10 4864 0.0 -1 1 {} H 0.0 {0.56424 0.399961 0.622191} H18 4865 0.0 -1 1 {} H 0.0 {0.559385 0.406485 0.643764} H19 4866 0.0 -1 1 {} H 0.0 {0.559432 0.444971 0.612727} H20 4867 0.0 -1 1 {} H 0.0 {0.569958 0.426106 0.599311} H22 4868 0.0 -1 1 {} H 0.0 {0.572213 0.451799 0.627596} H24 4869 0.0 -1 1 {} H 0.0 {0.589575 0.433802 0.637227} H25 4870 0.0 -1 1 {} H 0.0 {0.614777 0.422178 0.67762} H26 4871 0.0 -1 1 {} H 0.0 {0.618629 0.435378 0.666733} H27 4872 0.0 -1 1 {} H 0.0 {0.624553 0.420051 0.662863} H28 4873 0.0 -1 1 {} H 0.0 {0.602103 0.376132 0.65789} H29 4874 0.0 -1 1 {} H 0.0 {0.586512 0.374206 0.655973} H31 4875 0.0 -1 1 {} H 0.0 {0.573057 0.413028 0.663812} H32 4876 0.0 -1 1 {} H 0.0 {0.588591 0.431812 0.672758} H33 4877 0.0 -1 1 {} H 0.0 {0.602237 0.424871 0.631813} H34 4878 0.0 -1 7 {} N 0.0 {0.545497 0.42087 0.611449} N3 4879 0.0 -1 1 {} H 0.0 {0.542137 0.416404 0.620313} H16 4880 0.0 -1 1 {} H 0.0 {0.539116 0.428681 0.61002} H17 4881 0.0 -1 7 {} N 0.0 {0.563302 0.440485 0.650927} N6 4882 0.0 -1 1 {} H 0.0 {0.561237 0.450333 0.650293} H41 4883 0.0 -1 1 {} H 0.0 {0.571344 0.438812 0.656592} H42 4884 0.0 -1 14 {} Si 0.0 {0.57643 0.456559 0.711785} Si6 4885 0.0 -1 8 {} O 0.0 {0.584908 0.446623 0.72077} O6 4886 0.0 -1 14 {} Si 0.0 {0.58904 0.432561 0.724875} Si7 4887 0.0 -1 8 {} O 0.0 {0.583018 0.422935 0.714165} O7 4888 0.0 -1 14 {} Si 0.0 {0.577372 0.42097 0.700194} Si8 4889 0.0 -1 7 {} N 0.0 {0.337495 0.240627 0.557892} N2 4890 0.0 -1 14 {} Si 0.0 {0.325585 0.287118 0.576264} Si9 4891 0.0 -1 14 {} Si 0.0 {0.337456 0.240634 0.577367} Si10 4892 0.0 -1 6 {} C 0.0 {0.572993 0.455166 0.692798} C3 4893 0.0 -1 7 {} N 0.0 {0.604633 0.430044 0.7325} N 4894 0.0 -1 8 {} O 0.0 {0.572148 0.427241 0.737272} O8 4895 0.0 -1 8 {} O 0.0 {0.564708 0.458867 0.722459} O9 4896 0.0 -1 8 {} O 0.0 {0.588332 0.426449 0.690773} O10 4897 0.0 -1 1 {} H 0.0 {0.343568 0.248434 0.55594} H18 4898 0.0 -1 1 {} H 0.0 {0.359818 0.251312 0.481618} H19 4899 0.0 -1 1 {} H 0.0 {0.437119 0.236743 0.466513} H20 4900 0.0 -1 1 {} H 0.0 {0.256761 0.333128 0.581011} H22 4901 0.0 -1 1 {} H 0.0 {0.333852 0.22712 0.582882} H24 4902 0.0 -1 1 {} H 0.0 {0.293304 0.283595 0.60302} H25 4903 0.0 -1 1 {} H 0.0 {0.563412 0.44994 0.69249} H26 4904 0.0 -1 1 {} H 0.0 {0.581216 0.45026 0.688138} H27 4905 0.0 -1 1 {} H 0.0 {0.572267 0.465184 0.689625} H28 4906 0.0 -1 1 {} H 0.0 {0.60641 0.420191 0.734194} H29 4907 0.0 -1 1 {} H 0.0 {0.61198 0.433652 0.726753} H31 4908 0.0 -1 1 {} H 0.0 {0.568164 0.419654 0.731813} H32 4909 0.0 -1 1 {} H 0.0 {0.569188 0.456957 0.732739} H33 4910 0.0 -1 1 {} H 0.0 {0.596061 0.419922 0.690146} H34 4911 0.0 -1 7 {} N 0.0 {0.510765 0.6879 0.368598} N3 4912 0.0 -1 1 {} H 0.0 {0.508566 0.67769 0.368157} H16 4913 0.0 -1 1 {} H 0.0 {0.50794 0.691267 0.378141} H17 4914 0.0 -1 7 {} N 0.0 {0.356334 0.241335 0.580428} N6 4915 0.0 -1 1 {} H 0.0 {0.360041 0.236738 0.572597} H41 4916 0.0 -1 1 {} H 0.0 {0.357212 0.251263 0.578012} H42 4917 0.0 -1 14 {} Si 0.0 {0.676584 0.576696 0.498555} Si6 4918 0.0 -1 8 {} O 0.0 {0.674245 0.573115 0.483452} O6 4919 0.0 -1 14 {} Si 0.0 {0.674711 0.576392 0.467608} Si7 4920 0.0 -1 8 {} O 0.0 {0.690559 0.582788 0.495611} O7 4921 0.0 -1 14 {} Si 0.0 {0.704769 0.58354 0.48783} Si8 4922 0.0 -1 7 {} N 0.0 {0.708211 0.590024 0.469505} N2 4923 0.0 -1 14 {} Si 0.0 {0.692736 0.59216 0.468262} Si9 4924 0.0 -1 14 {} Si 0.0 {0.707056 0.579367 0.452403} Si10 4925 0.0 -1 6 {} C 0.0 {0.360943 0.401704 0.343405} C3 4926 0.0 -1 7 {} N 0.0 {0.674724 0.56301 0.45567} N 4927 0.0 -1 8 {} O 0.0 {0.665318 0.588982 0.466331} O8 4928 0.0 -1 8 {} O 0.0 {0.418094 0.345059 0.290542} O9 4929 0.0 -1 8 {} O 0.0 {0.704678 0.53486 0.380106} O10 4930 0.0 -1 1 {} H 0.0 {0.71563 0.589974 0.497629} H18 4931 0.0 -1 1 {} H 0.0 {0.709579 0.567541 0.48739} H19 4932 0.0 -1 1 {} H 0.0 {0.368876 0.560204 0.313354} H20 4933 0.0 -1 1 {} H 0.0 {0.653051 0.593538 0.417988} H22 4934 0.0 -1 1 {} H 0.0 {0.703726 0.564037 0.455144} H24 4935 0.0 -1 1 {} H 0.0 {0.700161 0.583747 0.440791} H25 4936 0.0 -1 1 {} H 0.0 {0.363014 0.391398 0.34151} H26 4937 0.0 -1 1 {} H 0.0 {0.665495 0.535398 0.506555} H27 4938 0.0 -1 1 {} H 0.0 {0.495825 0.446025 0.807501} H28 4939 0.0 -1 1 {} H 0.0 {0.682654 0.557298 0.457486} H29 4940 0.0 -1 1 {} H 0.0 {0.665725 0.55777 0.457348} H31 4941 0.0 -1 1 {} H 0.0 {0.671519 0.596608 0.467081} H32 4942 0.0 -1 1 {} H 0.0 {0.408516 0.346408 0.29016} H33 4943 0.0 -1 1 {} H 0.0 {0.695497 0.534807 0.383718} H34 4944 0.0 -1 7 {} N 0.0 {0.688941 0.609597 0.46472} N3 4945 0.0 -1 1 {} H 0.0 {0.697338 0.613506 0.461261} H16 4946 0.0 -1 1 {} H 0.0 {0.682717 0.609139 0.456294} H17 4947 0.0 -1 7 {} N 0.0 {0.68685 0.570855 0.420446} N6 4948 0.0 -1 1 {} H 0.0 {0.68116 0.56792 0.428435} H41 4949 0.0 -1 1 {} H 0.0 {0.680118 0.57599 0.41514} H42 4950 0.0 -1 14 {} Si 0.0 {0.343194 0.619375 0.604261} Si6 4951 0.0 -1 8 {} O 0.0 {0.379633 0.574397 0.516531} O6 4952 0.0 -1 14 {} Si 0.0 {0.371258 0.57053 0.529073} Si7 4953 0.0 -1 8 {} O 0.0 {0.389731 0.56821 0.495537} O7 4954 0.0 -1 14 {} Si 0.0 {0.393492 0.576045 0.509125} Si8 4955 0.0 -1 7 {} N 0.0 {0.410875 0.572636 0.517367} N2 4956 0.0 -1 14 {} Si 0.0 {0.415732 0.576635 0.532193} Si9 4957 0.0 -1 14 {} Si 0.0 {0.423768 0.565115 0.509873} Si10 4958 0.0 -1 6 {} C 0.0 {0.344209 0.605056 0.594549} C3 4959 0.0 -1 7 {} N 0.0 {0.373354 0.555165 0.539183} N 4960 0.0 -1 8 {} O 0.0 {0.353931 0.570484 0.51805} O8 4961 0.0 -1 8 {} O 0.0 {0.344525 0.599479 0.611386} O9 4962 0.0 -1 8 {} O 0.0 {0.287933 0.584282 0.563726} O10 4963 0.0 -1 1 {} H 0.0 {0.396182 0.560598 0.494114} H18 4964 0.0 -1 1 {} H 0.0 {0.393672 0.589628 0.504862} H19 4965 0.0 -1 1 {} H 0.0 {0.412145 0.565234 0.5432} H20 4966 0.0 -1 1 {} H 0.0 {0.434131 0.584439 0.552338} H22 4967 0.0 -1 1 {} H 0.0 {0.43024 0.556073 0.517254} H24 4968 0.0 -1 1 {} H 0.0 {0.434295 0.57309 0.50082} H25 4969 0.0 -1 1 {} H 0.0 {0.355343 0.627466 0.605264} H26 4970 0.0 -1 1 {} H 0.0 {0.335171 0.603143 0.589113} H27 4971 0.0 -1 1 {} H 0.0 {0.353574 0.604953 0.590032} H28 4972 0.0 -1 1 {} H 0.0 {0.400931 0.63631 0.433499} H29 4973 0.0 -1 1 {} H 0.0 {0.380849 0.556131 0.546074} H31 4974 0.0 -1 1 {} H 0.0 {0.347751 0.564357 0.522945} H32 4975 0.0 -1 1 {} H 0.0 {0.636347 0.473779 0.666178} H33 4976 0.0 -1 1 {} H 0.0 {0.282317 0.577202 0.56036} H34 4977 0.0 -1 7 {} N 0.0 {0.40784 0.593944 0.536655} N3 4978 0.0 -1 1 {} H 0.0 {0.409358 0.598018 0.545971} H16 4979 0.0 -1 1 {} H 0.0 {0.468549 0.524339 0.470851} H17 4980 0.0 -1 7 {} N 0.0 {0.415984 0.553692 0.496433} N6 4981 0.0 -1 1 {} H 0.0 {0.418566 0.545065 0.501453} H41 4982 0.0 -1 1 {} H 0.0 {0.424442 0.554263 0.490183} H42 4983 0.0 -1 14 {} Si 0.0 {0.481604 0.446313 0.719018} Si6 4984 0.0 -1 8 {} O 0.0 {0.49494 0.453804 0.723595} O6 4985 0.0 -1 14 {} Si 0.0 {0.510088 0.45289 0.726471} Si7 4986 0.0 -1 8 {} O 0.0 {0.511024 0.438074 0.731223} O7 4987 0.0 -1 14 {} Si 0.0 {0.520512 0.427929 0.740156} Si8 4988 0.0 -1 7 {} N 0.0 {0.533111 0.435919 0.748635} N2 4989 0.0 -1 14 {} Si 0.0 {0.527593 0.449647 0.755326} Si9 4990 0.0 -1 14 {} Si 0.0 {0.546504 0.431133 0.756724} Si10 4991 0.0 -1 6 {} C 0.0 {0.444106 0.534119 0.722121} C3 4992 0.0 -1 7 {} N 0.0 {0.46857 0.458729 0.712171} N 4993 0.0 -1 8 {} O 0.0 {0.451435 0.244536 0.406862} O8 4994 0.0 -1 8 {} O 0.0 {0.486075 0.439023 0.705556} O9 4995 0.0 -1 8 {} O 0.0 {0.508537 0.446855 0.688959} O10 4996 0.0 -1 1 {} H 0.0 {0.51181 0.422058 0.751975} H18 4997 0.0 -1 1 {} H 0.0 {0.527414 0.416949 0.729901} H19 4998 0.0 -1 1 {} H 0.0 {0.519894 0.446109 0.770401} H20 4999 0.0 -1 1 {} H 0.0 {0.539657 0.463033 0.758017} H22 5000 0.0 -1 1 {} H 0.0 {0.559127 0.430578 0.748904} H24 5001 0.0 -1 1 {} H 0.0 {0.544794 0.416144 0.764797} H25 5002 0.0 -1 1 {} H 0.0 {0.438766 0.533295 0.731235} H26 5003 0.0 -1 1 {} H 0.0 {0.508376 0.493929 0.657817} H27 5004 0.0 -1 1 {} H 0.0 {0.454473 0.53115 0.724182} H28 5005 0.0 -1 1 {} H 0.0 {0.474909 0.466288 0.708579} H29 5006 0.0 -1 1 {} H 0.0 {0.464108 0.454793 0.703624} H31 5007 0.0 -1 1 {} H 0.0 {0.456244 0.243911 0.397877} H32 5008 0.0 -1 1 {} H 0.0 {0.478561 0.558268 0.726988} H33 5009 0.0 -1 1 {} H 0.0 {0.503344 0.444125 0.697314} H34 5010 0.0 -1 7 {} N 0.0 {0.518578 0.464235 0.742536} N3 5011 0.0 -1 1 {} H 0.0 {0.510321 0.464869 0.748302} H16 5012 0.0 -1 1 {} H 0.0 {0.525203 0.471697 0.744455} H17 5013 0.0 -1 7 {} N 0.0 {0.547273 0.439891 0.773433} N6 5014 0.0 -1 1 {} H 0.0 {0.553356 0.433587 0.778999} H41 5015 0.0 -1 1 {} H 0.0 {0.537218 0.437831 0.776356} H42 5016 0.0 -1 14 {} Si 0.0 {0.565763 0.540186 0.403551} Si6 5017 0.0 -1 8 {} O 0.0 {0.581741 0.538454 0.404431} O6 5018 0.0 -1 14 {} Si 0.0 {0.594578 0.547609 0.401948} Si7 5019 0.0 -1 8 {} O 0.0 {0.590595 0.557175 0.414146} O7 5020 0.0 -1 14 {} Si 0.0 {0.591458 0.558978 0.429869} Si8 5021 0.0 -1 7 {} N 0.0 {0.609914 0.555478 0.434785} N2 5022 0.0 -1 14 {} Si 0.0 {0.619056 0.550955 0.449172} Si9 5023 0.0 -1 14 {} Si 0.0 {0.621376 0.543614 0.425134} Si10 5024 0.0 -1 6 {} C 0.0 {0.555332 0.526322 0.411343} C3 5025 0.0 -1 7 {} N 0.0 {0.608402 0.536889 0.410923} N 5026 0.0 -1 8 {} O 0.0 {0.593775 0.564245 0.38768} O8 5027 0.0 -1 8 {} O 0.0 {0.566016 0.540813 0.387768} O9 5028 0.0 -1 8 {} O 0.0 {0.562154 0.55898 0.409836} O10 5029 0.0 -1 1 {} H 0.0 {0.572255 0.55769 0.439152} H18 5030 0.0 -1 1 {} H 0.0 {0.591749 0.541301 0.437711} H19 5031 0.0 -1 1 {} H 0.0 {0.640087 0.543121 0.45689} H20 5032 0.0 -1 1 {} H 0.0 {0.614245 0.56512 0.432642} H22 5033 0.0 -1 1 {} H 0.0 {0.627249 0.539009 0.375231} H24 5034 0.0 -1 1 {} H 0.0 {0.625515 0.531952 0.432831} H25 5035 0.0 -1 1 {} H 0.0 {0.562805 0.522095 0.416734} H26 5036 0.0 -1 1 {} H 0.0 {0.552667 0.519921 0.402927} H27 5037 0.0 -1 1 {} H 0.0 {0.547458 0.530936 0.417001} H28 5038 0.0 -1 1 {} H 0.0 {0.603748 0.528482 0.413434} H29 5039 0.0 -1 1 {} H 0.0 {0.614851 0.535806 0.402775} H31 5040 0.0 -1 1 {} H 0.0 {0.603244 0.567226 0.387116} H32 5041 0.0 -1 1 {} H 0.0 {0.566848 0.550587 0.384203} H33 5042 0.0 -1 1 {} H 0.0 {0.569878 0.561022 0.415774} H34 5043 0.0 -1 7 {} N 0.0 {0.609814 0.541413 0.46013} N3 5044 0.0 -1 1 {} H 0.0 {0.613611 0.542627 0.469555} H16 5045 0.0 -1 1 {} H 0.0 {0.599853 0.544632 0.461219} H17 5046 0.0 -1 7 {} N 0.0 {0.634096 0.552523 0.415919} N6 5047 0.0 -1 1 {} H 0.0 {0.630313 0.5531 0.406023} H41 5048 0.0 -1 1 {} H 0.0 {0.642823 0.546752 0.414338} H42 5049 0.0 -1 14 {} Si 0.0 {0.48312 0.513141 0.80235} Si6 5050 0.0 -1 8 {} O 0.0 {0.721757 0.493575 0.43316} O6 5051 0.0 -1 14 {} Si 0.0 {0.734411 0.495426 0.421217} Si7 5052 0.0 -1 8 {} O 0.0 {0.359577 0.522743 0.664758} O7 5053 0.0 -1 14 {} Si 0.0 {0.486165 0.49956 0.774318} Si8 5054 0.0 -1 7 {} N 0.0 {0.477562 0.486076 0.769709} N2 5055 0.0 -1 14 {} Si 0.0 {0.72087 0.491464 0.381035} Si9 5056 0.0 -1 14 {} Si 0.0 {0.465053 0.465892 0.795765} Si10 5057 0.0 -1 6 {} C 0.0 {0.234734 0.340722 0.614793} C3 5058 0.0 -1 7 {} N 0.0 {0.748462 0.48327 0.41544} N 5059 0.0 -1 8 {} O 0.0 {0.728872 0.507876 0.412274} O8 5060 0.0 -1 8 {} O 0.0 {0.480568 0.530526 0.798728} O9 5061 0.0 -1 8 {} O 0.0 {0.482175 0.508655 0.787395} O10 5062 0.0 -1 1 {} H 0.0 {0.530804 0.624808 0.555662} H18 5063 0.0 -1 1 {} H 0.0 {0.712222 0.437543 0.417917} H19 5064 0.0 -1 1 {} H 0.0 {0.735944 0.499276 0.38412} H20 5065 0.0 -1 1 {} H 0.0 {0.718681 0.487326 0.39378} H22 5066 0.0 -1 1 {} H 0.0 {0.468988 0.449503 0.796333} H24 5067 0.0 -1 1 {} H 0.0 {0.449354 0.466902 0.813391} H25 5068 0.0 -1 1 {} H 0.0 {0.223754 0.341068 0.614326} H26 5069 0.0 -1 1 {} H 0.0 {0.404348 0.443994 0.283158} H27 5070 0.0 -1 1 {} H 0.0 {0.400031 0.449958 0.28159} H28 5071 0.0 -1 1 {} H 0.0 {0.74782 0.476511 0.42306} H29 5072 0.0 -1 1 {} H 0.0 {0.744994 0.479343 0.406497} H31 5073 0.0 -1 1 {} H 0.0 {0.708858 0.498649 0.425653} H32 5074 0.0 -1 1 {} H 0.0 {0.475273 0.530754 0.790429} H33 5075 0.0 -1 1 {} H 0.0 {0.70845 0.465234 0.424469} H34 5076 0.0 -1 7 {} N 0.0 {0.395982 0.238391 0.472895} N3 5077 0.0 -1 1 {} H 0.0 {0.718708 0.476916 0.370982} H16 5078 0.0 -1 1 {} H 0.0 {0.396053 0.230478 0.465814} H17 5079 0.0 -1 7 {} N 0.0 {0.50126 0.488956 0.663588} N6 5080 0.0 -1 1 {} H 0.0 {0.506366 0.484135 0.671175} H41 5081 0.0 -1 1 {} H 0.0 {0.496716 0.497258 0.667488} H42 5082 0.0 -1 14 {} Si 0.0 {0.771151 0.483139 0.497732} Si6 5083 0.0 -1 8 {} O 0.0 {0.760819 0.450923 0.504357} O6 5084 0.0 -1 14 {} Si 0.0 {0.77133 0.453451 0.492907} Si7 5085 0.0 -1 8 {} O 0.0 {0.743469 0.486983 0.470337} O7 5086 0.0 -1 14 {} Si 0.0 {0.749515 0.478948 0.508862} Si8 5087 0.0 -1 7 {} N 0.0 {0.734548 0.435214 0.506808} N2 5088 0.0 -1 14 {} Si 0.0 {0.728248 0.425958 0.494834} Si9 5089 0.0 -1 14 {} Si 0.0 {0.725431 0.471214 0.498599} Si10 5090 0.0 -1 6 {} C 0.0 {0.783345 0.479727 0.50897} C3 5091 0.0 -1 7 {} N 0.0 {0.775911 0.444245 0.478742} N 5092 0.0 -1 8 {} O 0.0 {0.762809 0.469084 0.484201} O8 5093 0.0 -1 8 {} O 0.0 {0.533258 0.627421 0.546484} O9 5094 0.0 -1 8 {} O 0.0 {0.78081 0.464606 0.499959} O10 5095 0.0 -1 1 {} H 0.0 {0.73781 0.475415 0.50377} H18 5096 0.0 -1 1 {} H 0.0 {0.755826 0.463657 0.507972} H19 5097 0.0 -1 1 {} H 0.0 {0.674044 0.398007 0.472011} H20 5098 0.0 -1 1 {} H 0.0 {0.717374 0.433264 0.486464} H22 5099 0.0 -1 1 {} H 0.0 {0.419814 0.47234 0.444648} H24 5100 0.0 -1 1 {} H 0.0 {0.6058 0.419207 0.543387} H25 5101 0.0 -1 1 {} H 0.0 {0.383753 0.329369 0.342764} H26 5102 0.0 -1 1 {} H 0.0 {0.792727 0.483866 0.507105} H27 5103 0.0 -1 1 {} H 0.0 {0.779864 0.479845 0.519248} H28 5104 0.0 -1 1 {} H 0.0 {0.780943 0.435424 0.481006} H29 5105 0.0 -1 1 {} H 0.0 {0.767311 0.439968 0.475326} H31 5106 0.0 -1 1 {} H 0.0 {0.459536 0.734691 0.568548} H32 5107 0.0 -1 1 {} H 0.0 {0.545166 0.627897 0.547392} H33 5108 0.0 -1 1 {} H 0.0 {0.584806 0.449736 0.790063} H34 5109 0.0 -1 7 {} N 0.0 {0.742376 0.421635 0.481057} N3 5110 0.0 -1 1 {} H 0.0 {0.735912 0.415735 0.475278} H16 5111 0.0 -1 1 {} H 0.0 {0.744918 0.429674 0.475432} H17 5112 0.0 -1 7 {} N 0.0 {0.675522 0.479661 0.497358} N6 5113 0.0 -1 1 {} H 0.0 {0.677119 0.485386 0.50568} H41 5114 0.0 -1 1 {} H 0.0 {0.683737 0.473306 0.495625} H42 5115 0.0 -1 14 {} Si 0.0 {0.385919 0.693558 0.626648} Si6 5116 0.0 -1 8 {} O 0.0 {0.572006 0.423792 0.785671} O6 5117 0.0 -1 14 {} Si 0.0 {0.506173 0.290914 0.72221} Si7 5118 0.0 -1 8 {} O 0.0 {0.48145 0.313232 0.741003} O7 5119 0.0 -1 14 {} Si 0.0 {0.480876 0.325043 0.730738} Si8 5120 0.0 -1 7 {} N 0.0 {0.471392 0.326417 0.716917} N2 5121 0.0 -1 14 {} Si 0.0 {0.45027 0.32081 0.757818} Si9 5122 0.0 -1 14 {} Si 0.0 {0.457291 0.339844 0.716822} Si10 5123 0.0 -1 6 {} C 0.0 {0.350386 0.703279 0.628378} C3 5124 0.0 -1 7 {} N 0.0 {0.493383 0.278401 0.713502} N 5125 0.0 -1 8 {} O 0.0 {0.76352 0.501645 0.489198} O8 5126 0.0 -1 8 {} O 0.0 {0.519748 0.290535 0.729856} O9 5127 0.0 -1 8 {} O 0.0 {0.507864 0.257433 0.656391} O10 5128 0.0 -1 1 {} H 0.0 {0.480109 0.337571 0.742442} H18 5129 0.0 -1 1 {} H 0.0 {0.49675 0.322706 0.722599} H19 5130 0.0 -1 1 {} H 0.0 {0.456894 0.330255 0.751352} H20 5131 0.0 -1 1 {} H 0.0 {0.447407 0.31159 0.748132} H22 5132 0.0 -1 1 {} H 0.0 {0.472118 0.345618 0.707042} H24 5133 0.0 -1 1 {} H 0.0 {0.46628 0.317631 0.713984} H25 5134 0.0 -1 1 {} H 0.0 {0.341194 0.702634 0.633097} H26 5135 0.0 -1 1 {} H 0.0 {0.372325 0.691208 0.627559} H27 5136 0.0 -1 1 {} H 0.0 {0.356488 0.710586 0.632633} H28 5137 0.0 -1 1 {} H 0.0 {0.494714 0.269885 0.719177} H29 5138 0.0 -1 1 {} H 0.0 {0.496202 0.275642 0.704421} H31 5139 0.0 -1 1 {} H 0.0 {0.404689 0.709344 0.641915} H32 5140 0.0 -1 1 {} H 0.0 {0.527082 0.294377 0.724752} H33 5141 0.0 -1 1 {} H 0.0 {0.281552 0.609768 0.260672} H34 5142 0.0 -1 7 {} N 0.0 {0.437304 0.326739 0.766674} N3 5143 0.0 -1 1 {} H 0.0 {0.440807 0.330668 0.775834} H16 5144 0.0 -1 1 {} H 0.0 {0.756537 0.502981 0.495602} H17 5145 0.0 -1 7 {} N 0.0 {0.442099 0.328002 0.709129} N6 5146 0.0 -1 1 {} H 0.0 {0.448378 0.319741 0.706641} H41 5147 0.0 -1 1 {} H 0.0 {0.441104 0.333353 0.700588} H42 5148 0.0 -1 14 {} Si 0.0 {0.568536 0.657385 0.504242} Si6 5149 0.0 -1 8 {} O 0.0 {0.563805 0.668485 0.514614} O6 5150 0.0 -1 14 {} Si 0.0 {0.563766 0.683137 0.521439} Si7 5151 0.0 -1 8 {} O 0.0 {0.559933 0.690678 0.508015} O7 5152 0.0 -1 14 {} Si 0.0 {0.55649 0.690302 0.492906} Si8 5153 0.0 -1 7 {} N 0.0 {0.541676 0.700601 0.485906} N2 5154 0.0 -1 14 {} Si 0.0 {0.537601 0.708695 0.499604} Si9 5155 0.0 -1 14 {} Si 0.0 {0.532405 0.701219 0.472638} Si10 5156 0.0 -1 6 {} C 0.0 {0.563124 0.658382 0.486723} C3 5157 0.0 -1 7 {} N 0.0 {0.55036 0.688576 0.534577} N 5158 0.0 -1 8 {} O 0.0 {0.580052 0.684883 0.521496} O8 5159 0.0 -1 8 {} O 0.0 {0.56605 0.644711 0.513324} O9 5160 0.0 -1 8 {} O 0.0 {0.587303 0.660884 0.511278} O10 5161 0.0 -1 1 {} H 0.0 {0.567779 0.697224 0.487086} H18 5162 0.0 -1 1 {} H 0.0 {0.557863 0.673867 0.486913} H19 5163 0.0 -1 1 {} H 0.0 {0.523451 0.717307 0.499814} H20 5164 0.0 -1 1 {} H 0.0 {0.531032 0.694413 0.50961} H22 5165 0.0 -1 1 {} H 0.0 {0.530803 0.715602 0.468794} H24 5166 0.0 -1 1 {} H 0.0 {0.517659 0.692689 0.473869} H25 5167 0.0 -1 1 {} H 0.0 {0.424543 0.64328 0.308094} H26 5168 0.0 -1 1 {} H 0.0 {0.57165 0.657475 0.481477} H27 5169 0.0 -1 1 {} H 0.0 {0.554587 0.653284 0.483122} H28 5170 0.0 -1 1 {} H 0.0 {0.548387 0.698469 0.532303} H29 5171 0.0 -1 1 {} H 0.0 {0.556573 0.689313 0.542997} H31 5172 0.0 -1 1 {} H 0.0 {0.582537 0.690687 0.513945} H32 5173 0.0 -1 1 {} H 0.0 {0.559578 0.637998 0.508922} H33 5174 0.0 -1 1 {} H 0.0 {0.585782 0.670791 0.514116} H34 5175 0.0 -1 7 {} N 0.0 {0.550354 0.718498 0.510045} N3 5176 0.0 -1 1 {} H 0.0 {0.553527 0.726564 0.504828} H16 5177 0.0 -1 1 {} H 0.0 {0.526444 0.664239 0.483722} H17 5178 0.0 -1 7 {} N 0.0 {0.543198 0.691532 0.458675} N6 5179 0.0 -1 1 {} H 0.0 {0.537411 0.683487 0.456345} H41 5180 0.0 -1 1 {} H 0.0 {0.552124 0.689125 0.463603} H42 5181 0.0 -1 14 {} Si 0.0 {0.378906 0.48026 0.445559} Si6 5182 0.0 -1 8 {} O 0.0 {0.367359 0.473582 0.437939} O6 5183 0.0 -1 14 {} Si 0.0 {0.355741 0.475114 0.428233} Si7 5184 0.0 -1 8 {} O 0.0 {0.361642 0.484999 0.4173} O7 5185 0.0 -1 14 {} Si 0.0 {0.366892 0.497574 0.409568} Si8 5186 0.0 -1 7 {} N 0.0 {0.375957 0.51056 0.415849} N2 5187 0.0 -1 14 {} Si 0.0 {0.365177 0.564152 0.431229} Si9 5188 0.0 -1 14 {} Si 0.0 {0.388833 0.499759 0.425211} Si10 5189 0.0 -1 6 {} C 0.0 {0.375335 0.490709 0.46068} C3 5190 0.0 -1 7 {} N 0.0 {0.34643 0.460934 0.423545} N 5191 0.0 -1 8 {} O 0.0 {0.341636 0.484473 0.440205} O8 5192 0.0 -1 8 {} O 0.0 {0.3929 0.464313 0.441469} O9 5193 0.0 -1 8 {} O 0.0 {0.347902 0.445666 0.458904} O10 5194 0.0 -1 1 {} H 0.0 {0.377089 0.491632 0.397198} H18 5195 0.0 -1 1 {} H 0.0 {0.35495 0.505444 0.401675} H19 5196 0.0 -1 1 {} H 0.0 {0.467013 0.554941 0.406957} H20 5197 0.0 -1 1 {} H 0.0 {0.488874 0.621129 0.340864} H22 5198 0.0 -1 1 {} H 0.0 {0.3966 0.493713 0.415929} H24 5199 0.0 -1 1 {} H 0.0 {0.384313 0.490284 0.434999} H25 5200 0.0 -1 1 {} H 0.0 {0.375096 0.483736 0.468545} H26 5201 0.0 -1 1 {} H 0.0 {0.365979 0.495822 0.458818} H27 5202 0.0 -1 1 {} H 0.0 {0.384198 0.4978 0.461697} H28 5203 0.0 -1 1 {} H 0.0 {0.336301 0.462515 0.423752} H29 5204 0.0 -1 1 {} H 0.0 {0.348132 0.457146 0.414562} H31 5205 0.0 -1 1 {} H 0.0 {0.338034 0.477813 0.445998} H32 5206 0.0 -1 1 {} H 0.0 {0.386282 0.456488 0.440627} H33 5207 0.0 -1 1 {} H 0.0 {0.339326 0.450029 0.456642} H34 5208 0.0 -1 7 {} N 0.0 {0.350298 0.638465 0.414779} N3 5209 0.0 -1 1 {} H 0.0 {0.341399 0.644719 0.414414} H16 5210 0.0 -1 1 {} H 0.0 {0.353185 0.63794 0.404534} H17 5211 0.0 -1 7 {} N 0.0 {0.383117 0.431673 0.39963} N6 5212 0.0 -1 1 {} H 0.0 {0.375201 0.438091 0.398604} H41 5213 0.0 -1 1 {} H 0.0 {0.384251 0.427555 0.390612} H42 5214 0.0 -1 14 {} Si 0.0 {0.502518 0.546269 0.672395} Si6 5215 0.0 -1 8 {} O 0.0 {0.491359 0.552122 0.662416} O6 5216 0.0 -1 14 {} Si 0.0 {0.481884 0.554808 0.650074} Si7 5217 0.0 -1 8 {} O 0.0 {0.492866 0.563456 0.64247} O7 5218 0.0 -1 14 {} Si 0.0 {0.506576 0.57049 0.641958} Si8 5219 0.0 -1 7 {} N 0.0 {0.50626 0.589413 0.648399} N2 5220 0.0 -1 14 {} Si 0.0 {0.490169 0.592797 0.64676} Si9 5221 0.0 -1 14 {} Si 0.0 {0.520541 0.599916 0.648085} Si10 5222 0.0 -1 6 {} C 0.0 {0.501014 0.550126 0.690559} C3 5223 0.0 -1 7 {} N 0.0 {0.468502 0.545646 0.639509} N 5224 0.0 -1 8 {} O 0.0 {0.472816 0.567868 0.657291} O8 5225 0.0 -1 8 {} O 0.0 {0.519083 0.550965 0.661609} O9 5226 0.0 -1 8 {} O 0.0 {0.500888 0.531581 0.666185} O10 5227 0.0 -1 1 {} H 0.0 {0.515536 0.559561 0.652401} H18 5228 0.0 -1 1 {} H 0.0 {0.563098 0.589665 0.662353} H19 5229 0.0 -1 1 {} H 0.0 {0.485415 0.595322 0.630863} H20 5230 0.0 -1 1 {} H 0.0 {0.481042 0.581318 0.652597} H22 5231 0.0 -1 1 {} H 0.0 {0.521031 0.607657 0.634024} H24 5232 0.0 -1 1 {} H 0.0 {0.532261 0.594489 0.64746} H25 5233 0.0 -1 1 {} H 0.0 {0.509959 0.55393 0.695426} H26 5234 0.0 -1 1 {} H 0.0 {0.498423 0.540762 0.695181} H27 5235 0.0 -1 1 {} H 0.0 {0.492263 0.556775 0.690105} H28 5236 0.0 -1 1 {} H 0.0 {0.47346 0.5365 0.639875} H29 5237 0.0 -1 1 {} H 0.0 {0.471717 0.549278 0.630434} H31 5238 0.0 -1 1 {} H 0.0 {0.47441 0.567199 0.666426} H32 5239 0.0 -1 1 {} H 0.0 {0.520808 0.54274 0.6559} H33 5240 0.0 -1 1 {} H 0.0 {0.492418 0.528609 0.66946} H34 5241 0.0 -1 7 {} N 0.0 {0.487035 0.605494 0.660301} N3 5242 0.0 -1 1 {} H 0.0 {0.477574 0.603488 0.662406} H16 5243 0.0 -1 1 {} H 0.0 {0.492787 0.601741 0.667715} H17 5244 0.0 -1 7 {} N 0.0 {0.518992 0.61073 0.664157} N6 5245 0.0 -1 1 {} H 0.0 {0.512056 0.607575 0.670848} H41 5246 0.0 -1 1 {} H 0.0 {0.514838 0.619521 0.661087} H42 5247 0.0 -1 14 {} Si 0.0 {0.52139 0.571917 0.410987} Si6 5248 0.0 -1 8 {} O 0.0 {0.526406 0.586428 0.413363} O6 5249 0.0 -1 14 {} Si 0.0 {0.535613 0.594704 0.42284} Si7 5250 0.0 -1 8 {} O 0.0 {0.547557 0.595671 0.413122} O7 5251 0.0 -1 14 {} Si 0.0 {0.556013 0.600435 0.400439} Si8 5252 0.0 -1 7 {} N 0.0 {0.563793 0.613288 0.393678} N2 5253 0.0 -1 14 {} Si 0.0 {0.571702 0.620737 0.382345} Si9 5254 0.0 -1 14 {} Si 0.0 {0.561225 0.577044 0.387076} Si10 5255 0.0 -1 6 {} C 0.0 {0.533106 0.558211 0.405004} C3 5256 0.0 -1 7 {} N 0.0 {0.526153 0.606317 0.432689} N 5257 0.0 -1 8 {} O 0.0 {0.539513 0.579252 0.435327} O8 5258 0.0 -1 8 {} O 0.0 {0.505807 0.577536 0.398954} O9 5259 0.0 -1 8 {} O 0.0 {0.513894 0.570868 0.424489} O10 5260 0.0 -1 1 {} H 0.0 {0.565747 0.63279 0.405089} H18 5261 0.0 -1 1 {} H 0.0 {0.580549 0.595083 0.397224} H19 5262 0.0 -1 1 {} H 0.0 {0.566384 0.617806 0.368099} H20 5263 0.0 -1 1 {} H 0.0 {0.573806 0.63464 0.385127} H22 5264 0.0 -1 1 {} H 0.0 {0.558563 0.588514 0.393675} H24 5265 0.0 -1 1 {} H 0.0 {0.549889 0.570871 0.383438} H25 5266 0.0 -1 1 {} H 0.0 {0.528126 0.549066 0.402844} H26 5267 0.0 -1 1 {} H 0.0 {0.541315 0.557231 0.41278} H27 5268 0.0 -1 1 {} H 0.0 {0.537485 0.561796 0.396036} H28 5269 0.0 -1 1 {} H 0.0 {0.531768 0.613106 0.43807} H29 5270 0.0 -1 1 {} H 0.0 {0.520718 0.601516 0.440323} H31 5271 0.0 -1 1 {} H 0.0 {0.531655 0.573834 0.432425} H32 5272 0.0 -1 1 {} H 0.0 {0.499033 0.57876 0.406762} H33 5273 0.0 -1 1 {} H 0.0 {0.506577 0.577116 0.425987} H34 5274 0.0 -1 7 {} N 0.0 {0.590003 0.61553 0.378076} N3 5275 0.0 -1 1 {} H 0.0 {0.590336 0.611611 0.368924} H16 5276 0.0 -1 1 {} H 0.0 {0.590225 0.607362 0.384633} H17 5277 0.0 -1 7 {} N 0.0 {0.466321 0.472037 0.514902} N6 5278 0.0 -1 1 {} H 0.0 {0.46347 0.467861 0.524085} H41 5279 0.0 -1 1 {} H 0.0 {0.45973 0.468539 0.507832} H42 5280 0.0 -1 14 {} Si 0.0 {0.438911 0.48503 0.730135} Si6 5281 0.0 -1 8 {} O 0.0 {0.434489 0.487907 0.715287} O6 5282 0.0 -1 14 {} Si 0.0 {0.438281 0.494083 0.701423} Si7 5283 0.0 -1 8 {} O 0.0 {0.439413 0.509133 0.706314} O7 5284 0.0 -1 14 {} Si 0.0 {0.435025 0.523313 0.711525} Si8 5285 0.0 -1 7 {} N 0.0 {0.427626 0.53464 0.69624} N2 5286 0.0 -1 14 {} Si 0.0 {0.41322 0.54015 0.690986} Si9 5287 0.0 -1 14 {} Si 0.0 {0.629498 0.450715 0.354411} Si10 5288 0.0 -1 6 {} C 0.0 {0.428509 0.492145 0.743095} C3 5289 0.0 -1 7 {} N 0.0 {0.45375 0.488864 0.695031} N 5290 0.0 -1 8 {} O 0.0 {0.416697 0.461943 0.688539} O8 5291 0.0 -1 8 {} O 0.0 {0.454734 0.487606 0.729856} O9 5292 0.0 -1 8 {} O 0.0 {0.443316 0.464003 0.728954} O10 5293 0.0 -1 1 {} H 0.0 {0.422719 0.519864 0.720852} H18 5294 0.0 -1 1 {} H 0.0 {0.294155 0.421973 0.520194} H19 5295 0.0 -1 1 {} H 0.0 {0.487316 0.182561 0.431057} H20 5296 0.0 -1 1 {} H 0.0 {0.408641 0.545246 0.706117} H22 5297 0.0 -1 1 {} H 0.0 {0.615923 0.456684 0.346764} H24 5298 0.0 -1 1 {} H 0.0 {0.629168 0.437719 0.363148} H25 5299 0.0 -1 1 {} H 0.0 {0.419209 0.486646 0.743145} H26 5300 0.0 -1 1 {} H 0.0 {0.426472 0.502259 0.741598} H27 5301 0.0 -1 1 {} H 0.0 {0.440099 0.495122 0.754905} H28 5302 0.0 -1 1 {} H 0.0 {0.456056 0.493046 0.685824} H29 5303 0.0 -1 1 {} H 0.0 {0.452266 0.478797 0.693162} H31 5304 0.0 -1 1 {} H 0.0 {0.412459 0.453943 0.69345} H32 5305 0.0 -1 1 {} H 0.0 {0.458167 0.485967 0.720715} H33 5306 0.0 -1 1 {} H 0.0 {0.45034 0.461638 0.721577} H34 5307 0.0 -1 7 {} N 0.0 {0.400939 0.527976 0.688233} N3 5308 0.0 -1 1 {} H 0.0 {0.403805 0.523485 0.679693} H16 5309 0.0 -1 1 {} H 0.0 {0.392414 0.532517 0.686301} H17 5310 0.0 -1 7 {} N 0.0 {0.530228 0.492823 0.682329} N6 5311 0.0 -1 1 {} H 0.0 {0.524439 0.485663 0.686908} H41 5312 0.0 -1 1 {} H 0.0 {0.525345 0.496066 0.674558} H42 5313 0.0 -1 14 {} Si 0.0 {0.472236 0.485452 0.249557} Si6 5314 0.0 -1 8 {} O 0.0 {0.387566 0.453905 0.233671} O6 5315 0.0 -1 14 {} Si 0.0 {0.398771 0.472561 0.259899} Si7 5316 0.0 -1 8 {} O 0.0 {0.399874 0.458059 0.254029} O7 5317 0.0 -1 14 {} Si 0.0 {0.395646 0.445679 0.244784} Si8 5318 0.0 -1 7 {} N 0.0 {0.400382 0.430135 0.244985} N2 5319 0.0 -1 14 {} Si 0.0 {0.693737 0.587749 0.429355} Si9 5320 0.0 -1 14 {} Si 0.0 {0.345767 0.479627 0.295589} Si10 5321 0.0 -1 6 {} C 0.0 {0.472192 0.473618 0.262451} C3 5322 0.0 -1 7 {} N 0.0 {0.205392 0.493678 0.602694} N 5323 0.0 -1 8 {} O 0.0 {0.706446 0.611511 0.381287} O8 5324 0.0 -1 8 {} O 0.0 {0.482524 0.497575 0.246718} O9 5325 0.0 -1 8 {} O 0.0 {0.472849 0.481139 0.230042} O10 5326 0.0 -1 1 {} H 0.0 {0.349242 0.222479 0.561472} H18 5327 0.0 -1 1 {} H 0.0 {0.37751 0.453673 0.236083} H19 5328 0.0 -1 1 {} H 0.0 {0.70737 0.593869 0.419226} H20 5329 0.0 -1 1 {} H 0.0 {0.684923 0.600563 0.432081} H22 5330 0.0 -1 1 {} H 0.0 {0.33491 0.481325 0.285794} H24 5331 0.0 -1 1 {} H 0.0 {0.351799 0.491487 0.29701} H25 5332 0.0 -1 1 {} H 0.0 {0.465395 0.475976 0.270108} H26 5333 0.0 -1 1 {} H 0.0 {0.468696 0.464741 0.258447} H27 5334 0.0 -1 1 {} H 0.0 {0.449713 0.724844 0.577119} H28 5335 0.0 -1 1 {} H 0.0 {0.493783 0.211205 0.551451} H29 5336 0.0 -1 1 {} H 0.0 {0.197849 0.49798 0.596998} H31 5337 0.0 -1 1 {} H 0.0 {0.70896 0.609125 0.372131} H32 5338 0.0 -1 1 {} H 0.0 {0.491323 0.493219 0.246481} H33 5339 0.0 -1 1 {} H 0.0 {0.463759 0.484681 0.227214} H34 5340 0.0 -1 7 {} N 0.0 {0.459314 0.72594 0.574445} N3 5341 0.0 -1 1 {} H 0.0 {0.729505 0.387315 0.533276} H16 5342 0.0 -1 1 {} H 0.0 {0.460966 0.71884 0.567608} H17 5343 0.0 -1 7 {} N 0.0 {0.342145 0.470087 0.308931} N6 5344 0.0 -1 1 {} H 0.0 {0.342708 0.475785 0.318271} H41 5345 0.0 -1 1 {} H 0.0 {0.33257 0.466249 0.308657} H42 5346 0.0 -1 14 {} Si 0.0 {0.445988 0.290188 0.645715} Si6 5347 0.0 -1 8 {} O 0.0 {0.440814 0.269022 0.659103} O6 5348 0.0 -1 14 {} Si 0.0 {0.437976 0.273853 0.678909} Si7 5349 0.0 -1 8 {} O 0.0 {0.438691 0.289476 0.678932} O7 5350 0.0 -1 14 {} Si 0.0 {0.445225 0.302748 0.67396} Si8 5351 0.0 -1 7 {} N 0.0 {0.434084 0.339804 0.677264} N2 5352 0.0 -1 14 {} Si 0.0 {0.438737 0.279611 0.707009} Si9 5353 0.0 -1 14 {} Si 0.0 {0.426148 0.326188 0.678728} Si10 5354 0.0 -1 6 {} C 0.0 {0.451111 0.273712 0.645439} C3 5355 0.0 -1 7 {} N 0.0 {0.421479 0.264461 0.681136} N 5356 0.0 -1 8 {} O 0.0 {0.45188 0.273409 0.685597} O8 5357 0.0 -1 8 {} O 0.0 {0.450757 0.301818 0.655616} O9 5358 0.0 -1 8 {} O 0.0 {0.430018 0.299458 0.640288} O10 5359 0.0 -1 1 {} H 0.0 {0.458041 0.303575 0.682337} H18 5360 0.0 -1 1 {} H 0.0 {0.435281 0.314177 0.675168} H19 5361 0.0 -1 1 {} H 0.0 {0.470889 0.27395 0.678401} H20 5362 0.0 -1 1 {} H 0.0 {0.429488 0.285813 0.697953} H22 5363 0.0 -1 1 {} H 0.0 {0.424501 0.321921 0.694677} H24 5364 0.0 -1 1 {} H 0.0 {0.412152 0.324493 0.672714} H25 5365 0.0 -1 1 {} H 0.0 {0.440673 0.268579 0.61237} H26 5366 0.0 -1 1 {} H 0.0 {0.461558 0.273139 0.648095} H27 5367 0.0 -1 1 {} H 0.0 {0.45168 0.270145 0.635485} H28 5368 0.0 -1 1 {} H 0.0 {0.423303 0.25496 0.684264} H29 5369 0.0 -1 1 {} H 0.0 {0.419057 0.264064 0.671564} H31 5370 0.0 -1 1 {} H 0.0 {0.403666 0.276668 0.698556} H32 5371 0.0 -1 1 {} H 0.0 {0.465529 0.298197 0.663941} H33 5372 0.0 -1 1 {} H 0.0 {0.432065 0.30913 0.64263} H34 5373 0.0 -1 7 {} N 0.0 {0.454233 0.288235 0.714955} N3 5374 0.0 -1 1 {} H 0.0 {0.46043 0.279877 0.714764} H16 5375 0.0 -1 1 {} H 0.0 {0.456637 0.292392 0.706229} H17 5376 0.0 -1 7 {} N 0.0 {0.42763 0.352937 0.679847} N6 5377 0.0 -1 1 {} H 0.0 {0.42565 0.354322 0.690111} H41 5378 0.0 -1 1 {} H 0.0 {0.41869 0.353662 0.675866} H42 5379 0.0 -1 14 {} Si 0.0 {0.50692 0.376153 0.583076} Si6 5380 0.0 -1 8 {} O 0.0 {0.508719 0.388663 0.593288} O6 5381 0.0 -1 14 {} Si 0.0 {0.508289 0.396843 0.606755} Si7 5382 0.0 -1 8 {} O 0.0 {0.52297 0.391136 0.611834} O7 5383 0.0 -1 14 {} Si 0.0 {0.533079 0.379543 0.610448} Si8 5384 0.0 -1 7 {} N 0.0 {0.535006 0.366862 0.621444} N2 5385 0.0 -1 14 {} Si 0.0 {0.545803 0.354771 0.624276} Si9 5386 0.0 -1 14 {} Si 0.0 {0.522705 0.367913 0.632515} Si10 5387 0.0 -1 6 {} C 0.0 {0.500869 0.380936 0.566163} C3 5388 0.0 -1 7 {} N 0.0 {0.499935 0.411732 0.609292} N 5389 0.0 -1 8 {} O 0.0 {0.499398 0.384805 0.621782} O8 5390 0.0 -1 8 {} O 0.0 {0.500187 0.365222 0.592417} O9 5391 0.0 -1 8 {} O 0.0 {0.523997 0.366134 0.584688} O10 5392 0.0 -1 1 {} H 0.0 {0.527068 0.371948 0.595808} H18 5393 0.0 -1 1 {} H 0.0 {0.549198 0.387537 0.606743} H19 5394 0.0 -1 1 {} H 0.0 {0.54943 0.356824 0.640774} H20 5395 0.0 -1 1 {} H 0.0 {0.540087 0.341549 0.622172} H22 5396 0.0 -1 1 {} H 0.0 {0.515034 0.35407 0.636755} H24 5397 0.0 -1 1 {} H 0.0 {0.508666 0.37778 0.625275} H25 5398 0.0 -1 1 {} H 0.0 {0.509775 0.380252 0.559695} H26 5399 0.0 -1 1 {} H 0.0 {0.49581 0.39076 0.566304} H27 5400 0.0 -1 1 {} H 0.0 {0.493145 0.374093 0.562939} H28 5401 0.0 -1 1 {} H 0.0 {0.490234 0.410307 0.606389} H29 5402 0.0 -1 1 {} H 0.0 {0.502682 0.418892 0.602817} H31 5403 0.0 -1 1 {} H 0.0 {0.499308 0.391311 0.629372} H32 5404 0.0 -1 1 {} H 0.0 {0.491713 0.362532 0.588206} H33 5405 0.0 -1 1 {} H 0.0 {0.521566 0.357128 0.58826} H34 5406 0.0 -1 7 {} N 0.0 {0.562312 0.355097 0.611934} N3 5407 0.0 -1 1 {} H 0.0 {0.570121 0.354939 0.618761} H16 5408 0.0 -1 1 {} H 0.0 {0.562571 0.364762 0.609512} H17 5409 0.0 -1 7 {} N 0.0 {0.527376 0.376114 0.650246} N6 5410 0.0 -1 1 {} H 0.0 {0.518516 0.375434 0.654804} H41 5411 0.0 -1 1 {} H 0.0 {0.532034 0.367521 0.654077} H42 5412 0.0 -1 14 {} Si 0.0 {0.578822 0.592783 0.620595} Si6 5413 0.0 -1 8 {} O 0.0 {0.563644 0.594642 0.622071} O6 5414 0.0 -1 14 {} Si 0.0 {0.549161 0.592674 0.616578} Si7 5415 0.0 -1 8 {} O 0.0 {0.543935 0.588728 0.631137} O7 5416 0.0 -1 14 {} Si 0.0 {0.54501 0.589185 0.646984} Si8 5417 0.0 -1 7 {} N 0.0 {0.554515 0.595509 0.662847} N2 5418 0.0 -1 14 {} Si 0.0 {0.559022 0.610814 0.65022} Si9 5419 0.0 -1 14 {} Si 0.0 {0.561089 0.608818 0.676413} Si10 5420 0.0 -1 6 {} C 0.0 {0.588923 0.597702 0.606202} C3 5421 0.0 -1 7 {} N 0.0 {0.542882 0.60741 0.602962} N 5422 0.0 -1 8 {} O 0.0 {0.549524 0.578607 0.609803} O8 5423 0.0 -1 8 {} O 0.0 {0.579893 0.571639 0.624163} O9 5424 0.0 -1 8 {} O 0.0 {0.58287 0.598076 0.635209} O10 5425 0.0 -1 1 {} H 0.0 {0.546684 0.561589 0.634897} H18 5426 0.0 -1 1 {} H 0.0 {0.5786 0.572055 0.634574} H19 5427 0.0 -1 1 {} H 0.0 {0.572559 0.605185 0.642215} H20 5428 0.0 -1 1 {} H 0.0 {0.549743 0.617089 0.638751} H22 5429 0.0 -1 1 {} H 0.0 {0.57339 0.617333 0.675209} H24 5430 0.0 -1 1 {} H 0.0 {0.56276 0.604547 0.691621} H25 5431 0.0 -1 1 {} H 0.0 {0.597161 0.603659 0.609775} H26 5432 0.0 -1 1 {} H 0.0 {0.582291 0.602784 0.599004} H27 5433 0.0 -1 1 {} H 0.0 {0.592675 0.588174 0.601497} H28 5434 0.0 -1 1 {} H 0.0 {0.534303 0.602759 0.600746} H29 5435 0.0 -1 1 {} H 0.0 {0.545755 0.611807 0.594399} H31 5436 0.0 -1 1 {} H 0.0 {0.55897 0.575216 0.609321} H32 5437 0.0 -1 1 {} H 0.0 {0.589867 0.57014 0.623875} H33 5438 0.0 -1 1 {} H 0.0 {0.608301 0.634388 0.575645} H34 5439 0.0 -1 7 {} N 0.0 {0.559692 0.628992 0.657986} N3 5440 0.0 -1 1 {} H 0.0 {0.550417 0.631843 0.65572} H16 5441 0.0 -1 1 {} H 0.0 {0.565067 0.632993 0.650386} H17 5442 0.0 -1 7 {} N 0.0 {0.545468 0.618481 0.686195} N6 5443 0.0 -1 1 {} H 0.0 {0.54454 0.625371 0.678563} H41 5444 0.0 -1 1 {} H 0.0 {0.538027 0.6115 0.683831} H42 5445 0.0 -1 14 {} Si 0.0 {0.529843 0.527289 0.69798} Si6 5446 0.0 -1 8 {} O 0.0 {0.528705 0.542712 0.702469} O6 5447 0.0 -1 14 {} Si 0.0 {0.536847 0.55482 0.709901} Si7 5448 0.0 -1 8 {} O 0.0 {0.550201 0.55351 0.700783} O7 5449 0.0 -1 14 {} Si 0.0 {0.557767 0.552096 0.687134} Si8 5450 0.0 -1 7 {} N 0.0 {0.569349 0.568565 0.687418} N2 5451 0.0 -1 14 {} Si 0.0 {0.580104 0.556336 0.699332} Si9 5452 0.0 -1 14 {} Si 0.0 {0.508633 0.518481 0.763128} Si10 5453 0.0 -1 6 {} C 0.0 {0.538122 0.524551 0.6806} C3 5454 0.0 -1 7 {} N 0.0 {0.530647 0.572111 0.714538} N 5455 0.0 -1 8 {} O 0.0 {0.542291 0.547917 0.72333} O8 5456 0.0 -1 8 {} O 0.0 {0.515247 0.521258 0.699021} O9 5457 0.0 -1 8 {} O 0.0 {0.536648 0.521537 0.711111} O10 5458 0.0 -1 1 {} H 0.0 {0.564008 0.537322 0.688502} H18 5459 0.0 -1 1 {} H 0.0 {0.549778 0.551128 0.674175} H19 5460 0.0 -1 1 {} H 0.0 {0.564441 0.543104 0.714366} H20 5461 0.0 -1 1 {} H 0.0 {0.590642 0.550302 0.693545} H22 5462 0.0 -1 1 {} H 0.0 {0.531139 0.525428 0.799689} H24 5463 0.0 -1 1 {} H 0.0 {0.509131 0.525973 0.775024} H25 5464 0.0 -1 1 {} H 0.0 {0.540826 0.53408 0.676078} H26 5465 0.0 -1 1 {} H 0.0 {0.53287 0.518544 0.673729} H27 5466 0.0 -1 1 {} H 0.0 {0.54711 0.519647 0.682619} H28 5467 0.0 -1 1 {} H 0.0 {0.539909 0.577022 0.71489} H29 5468 0.0 -1 1 {} H 0.0 {0.52607 0.577401 0.706795} H31 5469 0.0 -1 1 {} H 0.0 {0.540922 0.55363 0.73115} H32 5470 0.0 -1 1 {} H 0.0 {0.513061 0.521002 0.708408} H33 5471 0.0 -1 1 {} H 0.0 {0.538401 0.529589 0.716947} H34 5472 0.0 -1 7 {} N 0.0 {0.583832 0.567355 0.7138} N3 5473 0.0 -1 1 {} H 0.0 {0.591966 0.563116 0.718161} H16 5474 0.0 -1 1 {} H 0.0 {0.577066 0.565219 0.721039} H17 5475 0.0 -1 7 {} N 0.0 {0.523117 0.517493 0.755688} N6 5476 0.0 -1 1 {} H 0.0 {0.526555 0.507869 0.754612} H41 5477 0.0 -1 1 {} H 0.0 {0.606523 0.498607 0.677827} H42 5478 0.0 -1 14 {} Si 0.0 {0.490074 0.498921 0.522957} Si6 5479 0.0 -1 8 {} O 0.0 {0.498589 0.511427 0.528595} O6 5480 0.0 -1 14 {} Si 0.0 {0.511276 0.520744 0.532779} Si7 5481 0.0 -1 8 {} O 0.0 {0.505362 0.535312 0.534017} O7 5482 0.0 -1 14 {} Si 0.0 {0.493628 0.544872 0.530427} Si8 5483 0.0 -1 7 {} N 0.0 {0.493142 0.564114 0.534366} N2 5484 0.0 -1 14 {} Si 0.0 {0.511464 0.560944 0.526094} Si9 5485 0.0 -1 14 {} Si 0.0 {0.497163 0.578891 0.521778} Si10 5486 0.0 -1 6 {} C 0.0 {0.475909 0.501901 0.510645} C3 5487 0.0 -1 7 {} N 0.0 {0.518606 0.514437 0.549762} N 5488 0.0 -1 8 {} O 0.0 {0.520681 0.52125 0.519978} O8 5489 0.0 -1 8 {} O 0.0 {0.488092 0.54331 0.500725} O9 5490 0.0 -1 8 {} O 0.0 {0.468429 0.533129 0.544806} O10 5491 0.0 -1 1 {} H 0.0 {0.491214 0.542179 0.513288} H18 5492 0.0 -1 1 {} H 0.0 {0.480675 0.537082 0.537732} H19 5493 0.0 -1 1 {} H 0.0 {0.515678 0.549218 0.51715} H20 5494 0.0 -1 1 {} H 0.0 {0.475458 0.468699 0.511688} H22 5495 0.0 -1 1 {} H 0.0 {0.509982 0.573048 0.514249} H24 5496 0.0 -1 1 {} H 0.0 {0.501664 0.589709 0.528163} H25 5497 0.0 -1 1 {} H 0.0 {0.467478 0.504753 0.516451} H26 5498 0.0 -1 1 {} H 0.0 {0.473857 0.493312 0.505288} H27 5499 0.0 -1 1 {} H 0.0 {0.479584 0.51152 0.505736} H28 5500 0.0 -1 1 {} H 0.0 {0.51989 0.504585 0.550256} H29 5501 0.0 -1 1 {} H 0.0 {0.509586 0.515997 0.554711} H31 5502 0.0 -1 1 {} H 0.0 {0.495875 0.548117 0.496122} H32 5503 0.0 -1 1 {} H 0.0 {0.488338 0.533538 0.498044} H33 5504 0.0 -1 1 {} H 0.0 {0.470362 0.538553 0.552003} H34 5505 0.0 -1 7 {} N 0.0 {0.525121 0.567576 0.538457} N3 5506 0.0 -1 1 {} H 0.0 {0.521403 0.562132 0.546334} H16 5507 0.0 -1 1 {} H 0.0 {0.533101 0.561262 0.535827} H17 5508 0.0 -1 7 {} N 0.0 {0.481398 0.581194 0.509182} N6 5509 0.0 -1 1 {} H 0.0 {0.48314 0.572976 0.504009} H41 5510 0.0 -1 1 {} H 0.0 {0.483329 0.588547 0.50236} H42 5511 0.0 -1 14 {} Si 0.0 {0.6853 0.360974 0.637132} Si6 5512 0.0 -1 8 {} O 0.0 {0.675705 0.351072 0.629513} O6 5513 0.0 -1 14 {} Si 0.0 {0.660965 0.345509 0.625868} Si7 5514 0.0 -1 8 {} O 0.0 {0.663179 0.341236 0.610561} O7 5515 0.0 -1 14 {} Si 0.0 {0.665099 0.337308 0.595058} Si8 5516 0.0 -1 7 {} N 0.0 {0.662759 0.319431 0.587501} N2 5517 0.0 -1 14 {} Si 0.0 {0.662569 0.312296 0.573125} Si9 5518 0.0 -1 14 {} Si 0.0 {0.666983 0.310546 0.600009} Si10 5519 0.0 -1 6 {} C 0.0 {0.692527 0.357182 0.653526} C3 5520 0.0 -1 7 {} N 0.0 {0.656425 0.330682 0.636591} N 5521 0.0 -1 8 {} O 0.0 {0.652876 0.359153 0.624418} O8 5522 0.0 -1 8 {} O 0.0 {0.676081 0.374037 0.634103} O9 5523 0.0 -1 8 {} O 0.0 {0.697951 0.366902 0.622059} O10 5524 0.0 -1 1 {} H 0.0 {0.65386 0.34443 0.586769} H18 5525 0.0 -1 1 {} H 0.0 {0.677997 0.342119 0.590098} H19 5526 0.0 -1 1 {} H 0.0 {0.674816 0.318851 0.563273} H20 5527 0.0 -1 1 {} H 0.0 {0.620918 0.285099 0.61349} H22 5528 0.0 -1 1 {} H 0.0 {0.663619 0.296947 0.574173} H24 5529 0.0 -1 1 {} H 0.0 {0.655581 0.301888 0.605871} H25 5530 0.0 -1 1 {} H 0.0 {0.701185 0.36291 0.65532} H26 5531 0.0 -1 1 {} H 0.0 {0.694191 0.347225 0.653183} H27 5532 0.0 -1 1 {} H 0.0 {0.684976 0.358914 0.661427} H28 5533 0.0 -1 1 {} H 0.0 {0.655029 0.335086 0.645745} H29 5534 0.0 -1 1 {} H 0.0 {0.647268 0.328372 0.634034} H31 5535 0.0 -1 1 {} H 0.0 {0.659374 0.367852 0.613347} H32 5536 0.0 -1 1 {} H 0.0 {0.667134 0.37121 0.630593} H33 5537 0.0 -1 1 {} H 0.0 {0.346303 0.584462 0.301205} H34 5538 0.0 -1 7 {} N 0.0 {0.646397 0.318269 0.561922} N3 5539 0.0 -1 1 {} H 0.0 {0.638199 0.316839 0.567778} H16 5540 0.0 -1 1 {} H 0.0 {0.647073 0.328854 0.561228} H17 5541 0.0 -1 7 {} N 0.0 {0.682832 0.299643 0.597075} N6 5542 0.0 -1 1 {} H 0.0 {0.687857 0.300917 0.588564} H41 5543 0.0 -1 1 {} H 0.0 {0.688899 0.303972 0.60421} H42 5544 0.0 -1 14 {} Si 0.0 {0.451371 0.639491 0.444139} Si6 5545 0.0 -1 8 {} O 0.0 {0.449234 0.650348 0.455512} O6 5546 0.0 -1 14 {} Si 0.0 {0.442565 0.662728 0.46268} Si7 5547 0.0 -1 8 {} O 0.0 {0.44704 0.658214 0.477534} O7 5548 0.0 -1 14 {} Si 0.0 {0.445635 0.661043 0.493095} Si8 5549 0.0 -1 7 {} N 0.0 {0.456956 0.657629 0.50497} N2 5550 0.0 -1 14 {} Si 0.0 {0.461451 0.655832 0.520962} Si9 5551 0.0 -1 14 {} Si 0.0 {0.469934 0.651105 0.497706} Si10 5552 0.0 -1 6 {} C 0.0 {0.463201 0.641589 0.431697} C3 5553 0.0 -1 7 {} N 0.0 {0.444837 0.680702 0.455973} N 5554 0.0 -1 8 {} O 0.0 {0.427251 0.657882 0.461738} O8 5555 0.0 -1 8 {} O 0.0 {0.435415 0.637348 0.442557} O9 5556 0.0 -1 8 {} O 0.0 {0.45611 0.623371 0.458261} O10 5557 0.0 -1 1 {} H 0.0 {0.445143 0.677894 0.496526} H18 5558 0.0 -1 1 {} H 0.0 {0.434162 0.649865 0.501115} H19 5559 0.0 -1 1 {} H 0.0 {0.734427 0.413212 0.453934} H20 5560 0.0 -1 1 {} H 0.0 {0.451924 0.644514 0.525292} H22 5561 0.0 -1 1 {} H 0.0 {0.475621 0.658196 0.484242} H24 5562 0.0 -1 1 {} H 0.0 {0.453649 0.628315 0.466504} H25 5563 0.0 -1 1 {} H 0.0 {0.459157 0.665145 0.428301} H26 5564 0.0 -1 1 {} H 0.0 {0.45828 0.6408 0.422714} H27 5565 0.0 -1 1 {} H 0.0 {0.470034 0.633339 0.432801} H28 5566 0.0 -1 1 {} H 0.0 {0.448604 0.685717 0.463814} H29 5567 0.0 -1 1 {} H 0.0 {0.43546 0.682883 0.455656} H31 5568 0.0 -1 1 {} H 0.0 {0.425609 0.650741 0.454957} H32 5569 0.0 -1 1 {} H 0.0 {0.432286 0.629327 0.447419} H33 5570 0.0 -1 1 {} H 0.0 {0.447272 0.620212 0.457027} H34 5571 0.0 -1 7 {} N 0.0 {0.467217 0.67166 0.533053} N3 5572 0.0 -1 1 {} H 0.0 {0.470901 0.676611 0.525112} H16 5573 0.0 -1 1 {} H 0.0 {0.467696 0.665154 0.541234} H17 5574 0.0 -1 7 {} N 0.0 {0.484369 0.650678 0.507823} N6 5575 0.0 -1 1 {} H 0.0 {0.48886 0.641983 0.504906} H41 5576 0.0 -1 1 {} H 0.0 {0.489387 0.659555 0.504386} H42 5577 0.0 -1 14 {} Si 0.0 {0.460435 0.253113 0.557043} Si6 5578 0.0 -1 8 {} O 0.0 {0.440987 0.338881 0.618272} O6 5579 0.0 -1 14 {} Si 0.0 {0.4266 0.342167 0.640863} Si7 5580 0.0 -1 8 {} O 0.0 {0.437043 0.35116 0.648997} O7 5581 0.0 -1 14 {} Si 0.0 {0.407042 0.289314 0.61754} Si8 5582 0.0 -1 7 {} N 0.0 {0.393297 0.2992 0.620517} N2 5583 0.0 -1 14 {} Si 0.0 {0.398892 0.302601 0.636291} Si9 5584 0.0 -1 14 {} Si 0.0 {0.386484 0.288569 0.6051} Si10 5585 0.0 -1 6 {} C 0.0 {0.466473 0.237119 0.560079} C3 5586 0.0 -1 7 {} N 0.0 {0.40966 0.349818 0.636095} N 5587 0.0 -1 8 {} O 0.0 {0.42632 0.327733 0.647657} O8 5588 0.0 -1 8 {} O 0.0 {0.449171 0.260628 0.565194} O9 5589 0.0 -1 8 {} O 0.0 {0.472158 0.268606 0.554604} O10 5590 0.0 -1 1 {} H 0.0 {0.408458 0.277208 0.624014} H18 5591 0.0 -1 1 {} H 0.0 {0.449756 0.201495 0.361906} H19 5592 0.0 -1 1 {} H 0.0 {0.390726 0.29087 0.646006} H20 5593 0.0 -1 1 {} H 0.0 {0.415495 0.301289 0.637962} H22 5594 0.0 -1 1 {} H 0.0 {0.377909 0.279488 0.61533} H24 5595 0.0 -1 1 {} H 0.0 {0.436699 0.349783 0.658341} H25 5596 0.0 -1 1 {} H 0.0 {0.468881 0.23867 0.570291} H26 5597 0.0 -1 1 {} H 0.0 {0.475316 0.234353 0.554966} H27 5598 0.0 -1 1 {} H 0.0 {0.454777 0.317178 0.582507} H28 5599 0.0 -1 1 {} H 0.0 {0.402179 0.342749 0.636079} H29 5600 0.0 -1 1 {} H 0.0 {0.40784 0.354917 0.644434} H31 5601 0.0 -1 1 {} H 0.0 {0.432021 0.328531 0.655775} H32 5602 0.0 -1 1 {} H 0.0 {0.447068 0.256 0.573984} H33 5603 0.0 -1 1 {} H 0.0 {0.466559 0.274903 0.550182} H34 5604 0.0 -1 7 {} N 0.0 {0.396911 0.320065 0.639788} N3 5605 0.0 -1 1 {} H 0.0 {0.394166 0.323373 0.630539} H16 5606 0.0 -1 1 {} H 0.0 {0.406606 0.323302 0.640911} H17 5607 0.0 -1 7 {} N 0.0 {0.38017 0.304916 0.59469} N6 5608 0.0 -1 1 {} H 0.0 {0.375158 0.30198 0.585885} H41 5609 0.0 -1 1 {} H 0.0 {0.373644 0.310279 0.60036} H42 5610 0.0 -1 14 {} Si 0.0 {0.558947 0.389457 0.495728} Si6 5611 0.0 -1 8 {} O 0.0 {0.549379 0.401986 0.494943} O6 5612 0.0 -1 14 {} Si 0.0 {0.545983 0.416935 0.491662} Si7 5613 0.0 -1 8 {} O 0.0 {0.53214 0.418745 0.484935} O7 5614 0.0 -1 14 {} Si 0.0 {0.521451 0.426596 0.475822} Si8 5615 0.0 -1 7 {} N 0.0 {0.505081 0.432148 0.48127} N2 5616 0.0 -1 14 {} Si 0.0 {0.501672 0.447841 0.485742} Si9 5617 0.0 -1 14 {} Si 0.0 {0.502926 0.416714 0.491992} Si10 5618 0.0 -1 6 {} C 0.0 {0.573442 0.387191 0.507612} C3 5619 0.0 -1 7 {} N 0.0 {0.549181 0.427814 0.507951} N 5620 0.0 -1 8 {} O 0.0 {0.55716 0.41829 0.480165} O8 5621 0.0 -1 8 {} O 0.0 {0.561223 0.38809 0.479119} O9 5622 0.0 -1 8 {} O 0.0 {0.542611 0.378386 0.498696} O10 5623 0.0 -1 1 {} H 0.0 {0.527495 0.439734 0.473684} H18 5624 0.0 -1 1 {} H 0.0 {0.522135 0.417452 0.460568} H19 5625 0.0 -1 1 {} H 0.0 {0.512824 0.451704 0.491602} H20 5626 0.0 -1 1 {} H 0.0 {0.471673 0.4209 0.468893} H22 5627 0.0 -1 1 {} H 0.0 {0.443093 0.388185 0.504944} H24 5628 0.0 -1 1 {} H 0.0 {0.503825 0.401063 0.489283} H25 5629 0.0 -1 1 {} H 0.0 {0.572859 0.377612 0.512046} H26 5630 0.0 -1 1 {} H 0.0 {0.572023 0.393815 0.51552} H27 5631 0.0 -1 1 {} H 0.0 {0.583214 0.388759 0.503709} H28 5632 0.0 -1 1 {} H 0.0 {0.5423 0.435626 0.504958} H29 5633 0.0 -1 1 {} H 0.0 {0.557945 0.4324 0.505246} H31 5634 0.0 -1 1 {} H 0.0 {0.56617 0.419668 0.484431} H32 5635 0.0 -1 1 {} H 0.0 {0.556377 0.395251 0.475455} H33 5636 0.0 -1 1 {} H 0.0 {0.546204 0.369474 0.497251} H34 5637 0.0 -1 7 {} N 0.0 {0.486415 0.4509 0.497366} N3 5638 0.0 -1 1 {} H 0.0 {0.487461 0.461079 0.497607} H16 5639 0.0 -1 1 {} H 0.0 {0.478329 0.447217 0.491859} H17 5640 0.0 -1 7 {} N 0.0 {0.482945 0.417788 0.492068} N6 5641 0.0 -1 1 {} H 0.0 {0.480596 0.427555 0.489497} H41 5642 0.0 -1 1 {} H 0.0 {0.481249 0.416956 0.501359} H42 5643 0.0 -1 14 {} Si 0.0 {0.455297 0.567117 0.534761} Si6 5644 0.0 -1 8 {} O 0.0 {0.451507 0.552751 0.529158} O6 5645 0.0 -1 14 {} Si 0.0 {0.462684 0.578688 0.514531} Si7 5646 0.0 -1 8 {} O 0.0 {0.45567 0.590661 0.52087} O7 5647 0.0 -1 14 {} Si 0.0 {0.451921 0.605091 0.517123} Si8 5648 0.0 -1 7 {} N 0.0 {0.465793 0.615684 0.507745} N2 5649 0.0 -1 14 {} Si 0.0 {0.475413 0.616413 0.521276} Si9 5650 0.0 -1 14 {} Si 0.0 {0.464502 0.625514 0.49382} Si10 5651 0.0 -1 6 {} C 0.0 {0.435649 0.58394 0.542014} C3 5652 0.0 -1 7 {} N 0.0 {0.321148 0.596208 0.546227} N 5653 0.0 -1 8 {} O 0.0 {0.449937 0.57236 0.507744} O8 5654 0.0 -1 8 {} O 0.0 {0.438454 0.571138 0.593348} O9 5655 0.0 -1 8 {} O 0.0 {0.396397 0.523674 0.581184} O10 5656 0.0 -1 1 {} H 0.0 {0.436786 0.606063 0.510762} H18 5657 0.0 -1 1 {} H 0.0 {0.446824 0.611737 0.531502} H19 5658 0.0 -1 1 {} H 0.0 {0.480196 0.604201 0.526875} H20 5659 0.0 -1 1 {} H 0.0 {0.489755 0.620763 0.515932} H22 5660 0.0 -1 1 {} H 0.0 {0.467623 0.638323 0.495904} H24 5661 0.0 -1 1 {} H 0.0 {0.421397 0.635211 0.480442} H25 5662 0.0 -1 1 {} H 0.0 {0.466289 0.567541 0.543479} H26 5663 0.0 -1 1 {} H 0.0 {0.437397 0.592809 0.537028} H27 5664 0.0 -1 1 {} H 0.0 {0.442906 0.576406 0.539996} H28 5665 0.0 -1 1 {} H 0.0 {0.472314 0.472873 0.728422} H29 5666 0.0 -1 1 {} H 0.0 {0.321785 0.59071 0.554874} H31 5667 0.0 -1 1 {} H 0.0 {0.448615 0.563313 0.511545} H32 5668 0.0 -1 1 {} H 0.0 {0.453189 0.567326 0.58864} H33 5669 0.0 -1 1 {} H 0.0 {0.400587 0.514818 0.58638} H34 5670 0.0 -1 7 {} N 0.0 {0.469961 0.630489 0.533153} N3 5671 0.0 -1 1 {} H 0.0 {0.474294 0.638338 0.528266} H16 5672 0.0 -1 1 {} H 0.0 {0.47668 0.628715 0.540243} H17 5673 0.0 -1 7 {} N 0.0 {0.446839 0.623719 0.486479} N6 5674 0.0 -1 1 {} H 0.0 {0.441675 0.618792 0.494026} H41 5675 0.0 -1 1 {} H 0.0 {0.44413 0.633014 0.488757} H42 5676 0.0 -1 14 {} Si 0.0 {0.249703 0.417444 0.520997} Si6 5677 0.0 -1 8 {} O 0.0 {0.608718 0.584746 0.682181} O6 5678 0.0 -1 14 {} Si 0.0 {0.259327 0.425871 0.501478} Si7 5679 0.0 -1 8 {} O 0.0 {0.577022 0.59394 0.697748} O7 5680 0.0 -1 14 {} Si 0.0 {0.574853 0.587105 0.682891} Si8 5681 0.0 -1 7 {} N 0.0 {0.585198 0.588201 0.670337} N2 5682 0.0 -1 14 {} Si 0.0 {0.598809 0.595456 0.675339} Si9 5683 0.0 -1 14 {} Si 0.0 {0.590137 0.580717 0.65647} Si10 5684 0.0 -1 6 {} C 0.0 {0.615504 0.629791 0.581626} C3 5685 0.0 -1 7 {} N 0.0 {0.274604 0.433779 0.502924} N 5686 0.0 -1 8 {} O 0.0 {0.573804 0.54042 0.712414} O8 5687 0.0 -1 8 {} O 0.0 {0.264555 0.413585 0.524177} O9 5688 0.0 -1 8 {} O 0.0 {0.245145 0.432067 0.500582} O10 5689 0.0 -1 1 {} H 0.0 {0.600875 0.527307 0.70584} H18 5690 0.0 -1 1 {} H 0.0 {0.562879 0.571821 0.694729} H19 5691 0.0 -1 1 {} H 0.0 {0.360258 0.234176 0.497383} H20 5692 0.0 -1 1 {} H 0.0 {0.288513 0.456564 0.584548} H22 5693 0.0 -1 1 {} H 0.0 {0.604538 0.571539 0.655166} H24 5694 0.0 -1 1 {} H 0.0 {0.585735 0.590372 0.643642} H25 5695 0.0 -1 1 {} H 0.0 {0.260314 0.413933 0.491306} H26 5696 0.0 -1 1 {} H 0.0 {0.580823 0.586959 0.703948} H27 5697 0.0 -1 1 {} H 0.0 {0.624247 0.635838 0.582847} H28 5698 0.0 -1 1 {} H 0.0 {0.275418 0.436628 0.512817} H29 5699 0.0 -1 1 {} H 0.0 {0.273159 0.443361 0.498668} H31 5700 0.0 -1 1 {} H 0.0 {0.572541 0.53219 0.707454} H32 5701 0.0 -1 1 {} H 0.0 {0.2649 0.404218 0.52283} H33 5702 0.0 -1 1 {} H 0.0 {0.246643 0.441644 0.498373} H34 5703 0.0 -1 7 {} N 0.0 {0.598595 0.617092 0.671838} N3 5704 0.0 -1 1 {} H 0.0 {0.601317 0.62003 0.681718} H16 5705 0.0 -1 1 {} H 0.0 {0.592465 0.624387 0.667481} H17 5706 0.0 -1 7 {} N 0.0 {0.575584 0.568088 0.65481} N6 5707 0.0 -1 1 {} H 0.0 {0.572793 0.566457 0.664518} H41 5708 0.0 -1 1 {} H 0.0 {0.568294 0.573837 0.650192} H42 5709 0.0 -1 14 {} Si 0.0 {0.463304 0.544384 0.236282} Si6 5710 0.0 -1 8 {} O 0.0 {0.477031 0.551439 0.235189} O6 5711 0.0 -1 14 {} Si 0.0 {0.492839 0.551746 0.235145} Si7 5712 0.0 -1 8 {} O 0.0 {0.229181 0.507863 0.643968} O7 5713 0.0 -1 14 {} Si 0.0 {0.222237 0.513108 0.65677} Si8 5714 0.0 -1 7 {} N 0.0 {0.214081 0.530882 0.651349} N2 5715 0.0 -1 14 {} Si 0.0 {0.227665 0.530234 0.642437} Si9 5716 0.0 -1 14 {} Si 0.0 {0.446948 0.507701 0.216505} Si10 5717 0.0 -1 6 {} C 0.0 {0.460281 0.520849 0.235462} C3 5718 0.0 -1 7 {} N 0.0 {0.499425 0.568883 0.22732} N 5719 0.0 -1 8 {} O 0.0 {0.494603 0.536597 0.233003} O8 5720 0.0 -1 8 {} O 0.0 {0.453459 0.556867 0.239346} O9 5721 0.0 -1 8 {} O 0.0 {0.462092 0.535532 0.255621} O10 5722 0.0 -1 1 {} H 0.0 {0.458497 0.56513 0.239637} H18 5723 0.0 -1 1 {} H 0.0 {0.232716 0.515279 0.667509} H19 5724 0.0 -1 1 {} H 0.0 {0.24988 0.499158 0.618264} H20 5725 0.0 -1 1 {} H 0.0 {0.190084 0.503001 0.624022} H22 5726 0.0 -1 1 {} H 0.0 {0.431825 0.513197 0.221986} H24 5727 0.0 -1 1 {} H 0.0 {0.456987 0.518354 0.196362} H25 5728 0.0 -1 1 {} H 0.0 {0.469909 0.517582 0.238041} H26 5729 0.0 -1 1 {} H 0.0 {0.455743 0.51893 0.225484} H27 5730 0.0 -1 1 {} H 0.0 {0.454175 0.519529 0.243974} H28 5731 0.0 -1 1 {} H 0.0 {0.490277 0.573182 0.226131} H29 5732 0.0 -1 1 {} H 0.0 {0.503024 0.565418 0.218505} H31 5733 0.0 -1 1 {} H 0.0 {0.492438 0.533307 0.223038} H32 5734 0.0 -1 1 {} H 0.0 {0.372529 0.529741 0.229441} H33 5735 0.0 -1 1 {} H 0.0 {0.471329 0.536901 0.258396} H34 5736 0.0 -1 7 {} N 0.0 {0.239137 0.547146 0.643583} N3 5737 0.0 -1 1 {} H 0.0 {0.24271 0.544258 0.652886} H16 5738 0.0 -1 1 {} H 0.0 {0.233331 0.555387 0.645883} H17 5739 0.0 -1 7 {} N 0.0 {0.447126 0.493247 0.223816} N6 5740 0.0 -1 1 {} H 0.0 {0.443721 0.49443 0.232772} H41 5741 0.0 -1 1 {} H 0.0 {0.218557 0.556849 0.606823} H42 5742 0.0 -1 14 {} Si 0.0 {0.545379 0.375875 0.403737} Si6 5743 0.0 -1 8 {} O 0.0 {0.567196 0.332267 0.483163} O6 5744 0.0 -1 14 {} Si 0.0 {0.577938 0.328548 0.472518} Si7 5745 0.0 -1 8 {} O 0.0 {0.592601 0.3326 0.477833} O7 5746 0.0 -1 14 {} Si 0.0 {0.601765 0.34363 0.483958} Si8 5747 0.0 -1 7 {} N 0.0 {0.603006 0.345478 0.500521} N2 5748 0.0 -1 14 {} Si 0.0 {0.546886 0.361303 0.46963} Si9 5749 0.0 -1 14 {} Si 0.0 {0.613015 0.328526 0.50244} Si10 5750 0.0 -1 6 {} C 0.0 {0.528567 0.371068 0.3973} C3 5751 0.0 -1 7 {} N 0.0 {0.597512 0.350718 0.417462} N 5752 0.0 -1 8 {} O 0.0 {0.635978 0.331183 0.472066} O8 5753 0.0 -1 8 {} O 0.0 {0.568027 0.389696 0.405768} O9 5754 0.0 -1 8 {} O 0.0 {0.508747 0.359782 0.415226} O10 5755 0.0 -1 1 {} H 0.0 {0.619766 0.342284 0.453416} H18 5756 0.0 -1 1 {} H 0.0 {0.539048 0.387117 0.42382} H19 5757 0.0 -1 1 {} H 0.0 {0.537721 0.35053 0.461016} H20 5758 0.0 -1 1 {} H 0.0 {0.554661 0.374685 0.475264} H22 5759 0.0 -1 1 {} H 0.0 {0.627375 0.329402 0.499156} H24 5760 0.0 -1 1 {} H 0.0 {0.607493 0.315242 0.500076} H25 5761 0.0 -1 1 {} H 0.0 {0.52134 0.3738 0.405305} H26 5762 0.0 -1 1 {} H 0.0 {0.52917 0.360571 0.394826} H27 5763 0.0 -1 1 {} H 0.0 {0.526664 0.377261 0.38871} H28 5764 0.0 -1 1 {} H 0.0 {0.602159 0.345118 0.425115} H29 5765 0.0 -1 1 {} H 0.0 {0.5996 0.360455 0.419375} H31 5766 0.0 -1 1 {} H 0.0 {0.637657 0.326814 0.463777} H32 5767 0.0 -1 1 {} H 0.0 {0.561031 0.426008 0.352054} H33 5768 0.0 -1 1 {} H 0.0 {0.572235 0.521897 0.577169} H34 5769 0.0 -1 7 {} N 0.0 {0.553501 0.367462 0.451235} N3 5770 0.0 -1 1 {} H 0.0 {0.545659 0.362693 0.446275} H16 5771 0.0 -1 1 {} H 0.0 {0.561613 0.362462 0.448136} H17 5772 0.0 -1 7 {} N 0.0 {0.610917 0.327839 0.522184} N6 5773 0.0 -1 1 {} H 0.0 {0.601268 0.323381 0.522307} H41 5774 0.0 -1 1 {} H 0.0 {0.609064 0.337578 0.522909} H42 5775 0.0 -1 14 {} Si 0.0 {0.449208 0.680206 0.408154} Si6 5776 0.0 -1 8 {} O 0.0 {0.447155 0.66916 0.425143} O6 5777 0.0 -1 14 {} Si 0.0 {0.631702 0.286155 0.60628} Si7 5778 0.0 -1 8 {} O 0.0 {0.62818 0.294807 0.593896} O7 5779 0.0 -1 14 {} Si 0.0 {0.625752 0.310526 0.590013} Si8 5780 0.0 -1 7 {} N 0.0 {0.610721 0.316868 0.587062} N2 5781 0.0 -1 14 {} Si 0.0 {0.599555 0.324379 0.577649} Si9 5782 0.0 -1 14 {} Si 0.0 {0.60256 0.308705 0.598588} Si10 5783 0.0 -1 6 {} C 0.0 {0.437971 0.682277 0.396367} C3 5784 0.0 -1 7 {} N 0.0 {0.634695 0.26713 0.597682} N 5785 0.0 -1 8 {} O 0.0 {0.644045 0.295489 0.613467} O8 5786 0.0 -1 8 {} O 0.0 {0.45968 0.69063 0.414706} O9 5787 0.0 -1 8 {} O 0.0 {0.508933 0.651977 0.422718} O10 5788 0.0 -1 1 {} H 0.0 {0.744969 0.403461 0.461715} H18 5789 0.0 -1 1 {} H 0.0 {0.633306 0.318684 0.599766} H19 5790 0.0 -1 1 {} H 0.0 {0.601604 0.313441 0.566802} H20 5791 0.0 -1 1 {} H 0.0 {0.583605 0.321077 0.582609} H22 5792 0.0 -1 1 {} H 0.0 {0.593929 0.294894 0.594397} H24 5793 0.0 -1 1 {} H 0.0 {0.603316 0.318582 0.611941} H25 5794 0.0 -1 1 {} H 0.0 {0.442138 0.681437 0.387265} H26 5795 0.0 -1 1 {} H 0.0 {0.428343 0.678398 0.398291} H27 5796 0.0 -1 1 {} H 0.0 {0.631737 0.258013 0.602495} H28 5797 0.0 -1 1 {} H 0.0 {0.629255 0.268157 0.589219} H29 5798 0.0 -1 1 {} H 0.0 {0.644643 0.266846 0.594585} H31 5799 0.0 -1 1 {} H 0.0 {0.64025 0.302195 0.619677} H32 5800 0.0 -1 1 {} H 0.0 {0.468001 0.686337 0.417002} H33 5801 0.0 -1 1 {} H 0.0 {0.447636 0.676219 0.432746} H34 5802 0.0 -1 7 {} N 0.0 {0.604523 0.342347 0.573664} N3 5803 0.0 -1 1 {} H 0.0 {0.609303 0.34081 0.565128} H16 5804 0.0 -1 1 {} H 0.0 {0.595239 0.345069 0.570925} H17 5805 0.0 -1 7 {} N 0.0 {0.743869 0.40944 0.453345} N6 5806 0.0 -1 1 {} H 0.0 {0.504152 0.253951 0.646267} H41 5807 0.0 -1 1 {} H 0.0 {0.750035 0.41798 0.454319} H42 5808 0.0 -1 14 {} Si 0.0 {0.49903 0.449312 0.544447} Si6 5809 0.0 -1 8 {} O 0.0 {0.496521 0.442149 0.559089} O6 5810 0.0 -1 14 {} Si 0.0 {0.48655 0.438939 0.571568} Si7 5811 0.0 -1 8 {} O 0.0 {0.472777 0.438757 0.563921} O7 5812 0.0 -1 14 {} Si 0.0 {0.45963 0.437691 0.554913} Si8 5813 0.0 -1 7 {} N 0.0 {0.383212 0.438885 0.533901} N2 5814 0.0 -1 14 {} Si 0.0 {0.390384 0.421073 0.537001} Si9 5815 0.0 -1 14 {} Si 0.0 {0.374706 0.455208 0.524331} Si10 5816 0.0 -1 6 {} C 0.0 {0.490096 0.444939 0.52757} C3 5817 0.0 -1 7 {} N 0.0 {0.487718 0.422943 0.580571} N 5818 0.0 -1 8 {} O 0.0 {0.486128 0.454383 0.576614} O8 5819 0.0 -1 8 {} O 0.0 {0.515052 0.451461 0.545764} O9 5820 0.0 -1 8 {} O 0.0 {0.458307 0.450671 0.537988} O10 5821 0.0 -1 1 {} H 0.0 {0.447935 0.440547 0.563348} H18 5822 0.0 -1 1 {} H 0.0 {0.45674 0.42286 0.551787} H19 5823 0.0 -1 1 {} H 0.0 {0.377547 0.439004 0.542183} H20 5824 0.0 -1 1 {} H 0.0 {0.397149 0.454594 0.56875} H22 5825 0.0 -1 1 {} H 0.0 {0.369319 0.452068 0.511709} H24 5826 0.0 -1 1 {} H 0.0 {0.387058 0.485182 0.505761} H25 5827 0.0 -1 1 {} H 0.0 {0.492863 0.434851 0.525116} H26 5828 0.0 -1 1 {} H 0.0 {0.491794 0.452174 0.519748} H27 5829 0.0 -1 1 {} H 0.0 {0.479553 0.445106 0.529431} H28 5830 0.0 -1 1 {} H 0.0 {0.479867 0.417494 0.57716} H29 5831 0.0 -1 1 {} H 0.0 {0.486208 0.424114 0.590164} H31 5832 0.0 -1 1 {} H 0.0 {0.488942 0.460293 0.568868} H32 5833 0.0 -1 1 {} H 0.0 {0.53145 0.429306 0.55561} H33 5834 0.0 -1 1 {} H 0.0 {0.448953 0.450612 0.535143} H34 5835 0.0 -1 7 {} N 0.0 {0.377177 0.408202 0.54349} N3 5836 0.0 -1 1 {} H 0.0 {0.384059 0.404126 0.549578} H16 5837 0.0 -1 1 {} H 0.0 {0.371359 0.413595 0.549711} H17 5838 0.0 -1 7 {} N 0.0 {0.389966 0.466266 0.521332} N6 5839 0.0 -1 1 {} H 0.0 {0.392196 0.462856 0.512131} H41 5840 0.0 -1 1 {} H 0.0 {0.396844 0.461292 0.527041} H42 5841 0.0 -1 14 {} Si 0.0 {0.419306 0.575999 0.225679} Si6 5842 0.0 -1 8 {} O 0.0 {0.418557 0.568828 0.241554} O6 5843 0.0 -1 14 {} Si 0.0 {0.41651 0.55721 0.250575} Si7 5844 0.0 -1 8 {} O 0.0 {0.400489 0.557669 0.251025} O7 5845 0.0 -1 14 {} Si 0.0 {0.388447 0.559611 0.241612} Si8 5846 0.0 -1 7 {} N 0.0 {0.385336 0.575217 0.23123} N2 5847 0.0 -1 14 {} Si 0.0 {0.378033 0.589254 0.235863} Si9 5848 0.0 -1 14 {} Si 0.0 {0.386318 0.580102 0.215311} Si10 5849 0.0 -1 6 {} C 0.0 {0.409081 0.572044 0.212423} C3 5850 0.0 -1 7 {} N 0.0 {0.425857 0.542443 0.24479} N 5851 0.0 -1 8 {} O 0.0 {0.428503 0.56866 0.273581} O8 5852 0.0 -1 8 {} O 0.0 {0.437494 0.573194 0.22476} O9 5853 0.0 -1 8 {} O 0.0 {0.419819 0.594571 0.234448} O10 5854 0.0 -1 1 {} H 0.0 {0.385153 0.545373 0.234475} H18 5855 0.0 -1 1 {} H 0.0 {0.376874 0.56122 0.251018} H19 5856 0.0 -1 1 {} H 0.0 {0.372816 0.600624 0.227581} H20 5857 0.0 -1 1 {} H 0.0 {0.36566 0.586193 0.247308} H22 5858 0.0 -1 1 {} H 0.0 {0.582351 0.225167 0.344192} H24 5859 0.0 -1 1 {} H 0.0 {0.460919 0.502059 0.816766} H25 5860 0.0 -1 1 {} H 0.0 {0.408897 0.561706 0.210096} H26 5861 0.0 -1 1 {} H 0.0 {0.412826 0.575709 0.203242} H27 5862 0.0 -1 1 {} H 0.0 {0.385947 0.595802 0.214083} H28 5863 0.0 -1 1 {} H 0.0 {0.435251 0.546547 0.243474} H29 5864 0.0 -1 1 {} H 0.0 {0.426547 0.535404 0.251902} H31 5865 0.0 -1 1 {} H 0.0 {0.422691 0.563299 0.264868} H32 5866 0.0 -1 1 {} H 0.0 {0.439208 0.566311 0.231337} H33 5867 0.0 -1 1 {} H 0.0 {0.409738 0.597218 0.237236} H34 5868 0.0 -1 7 {} N 0.0 {0.389412 0.59877 0.247365} N3 5869 0.0 -1 1 {} H 0.0 {0.384548 0.605562 0.253003} H16 5870 0.0 -1 1 {} H 0.0 {0.390891 0.59025 0.253531} H17 5871 0.0 -1 7 {} N 0.0 {0.6501 0.635647 0.43205} N6 5872 0.0 -1 1 {} H 0.0 {0.788182 0.431298 0.499971} H41 5873 0.0 -1 1 {} H 0.0 {0.651341 0.625293 0.431752} H42 5874 0.0 -1 14 {} Si 0.0 {0.295449 0.265474 0.592188} Si6 5875 0.0 -1 8 {} O 0.0 {0.294791 0.28104 0.593894} O6 5876 0.0 -1 14 {} Si 0.0 {0.616446 0.319225 0.69259} Si7 5877 0.0 -1 8 {} O 0.0 {0.330904 0.277311 0.587054} O7 5878 0.0 -1 14 {} Si 0.0 {0.326868 0.26433 0.594687} Si8 5879 0.0 -1 7 {} N 0.0 {0.309706 0.233151 0.552993} N2 5880 0.0 -1 14 {} Si 0.0 {0.271024 0.325399 0.576262} Si9 5881 0.0 -1 14 {} Si 0.0 {0.322401 0.246363 0.558733} Si10 5882 0.0 -1 6 {} C 0.0 {0.285792 0.256055 0.578428} C3 5883 0.0 -1 7 {} N 0.0 {0.335779 0.288317 0.560361} N 5884 0.0 -1 8 {} O 0.0 {0.618911 0.311673 0.70641} O8 5885 0.0 -1 8 {} O 0.0 {0.293638 0.263587 0.609204} O9 5886 0.0 -1 8 {} O 0.0 {0.31162 0.265427 0.591876} O10 5887 0.0 -1 1 {} H 0.0 {0.565765 0.427478 0.699953} H18 5888 0.0 -1 1 {} H 0.0 {0.332009 0.252621 0.586655} H19 5889 0.0 -1 1 {} H 0.0 {0.283745 0.321536 0.584727} H20 5890 0.0 -1 1 {} H 0.0 {0.305293 0.319787 0.614455} H22 5891 0.0 -1 1 {} H 0.0 {0.48524 0.399595 0.339571} H24 5892 0.0 -1 1 {} H 0.0 {0.597328 0.520389 0.648672} H25 5893 0.0 -1 1 {} H 0.0 {0.275882 0.259846 0.57976} H26 5894 0.0 -1 1 {} H 0.0 {0.287416 0.245528 0.578891} H27 5895 0.0 -1 1 {} H 0.0 {0.289209 0.260508 0.569395} H28 5896 0.0 -1 1 {} H 0.0 {0.26828 0.2483 0.52214} H29 5897 0.0 -1 1 {} H 0.0 {0.645102 0.332146 0.685468} H31 5898 0.0 -1 1 {} H 0.0 {0.612123 0.314504 0.712778} H32 5899 0.0 -1 1 {} H 0.0 {0.301754 0.265346 0.612884} H33 5900 0.0 -1 1 {} H 0.0 {0.416377 0.255873 0.391655} H34 5901 0.0 -1 7 {} N 0.0 {0.281113 0.338021 0.565077} N3 5902 0.0 -1 1 {} H 0.0 {0.276643 0.335073 0.555916} H16 5903 0.0 -1 1 {} H 0.0 {0.276037 0.345975 0.568108} H17 5904 0.0 -1 7 {} N 0.0 {0.612049 0.463022 0.736932} N6 5905 0.0 -1 1 {} H 0.0 {0.310616 0.236272 0.543076} H41 5906 0.0 -1 1 {} H 0.0 {0.607695 0.48512 0.756089} H42 5907 0.0 -1 14 {} Si 0.0 {0.617347 0.623992 0.286851} Si6 5908 0.0 -1 8 {} O 0.0 {0.608866 0.635495 0.279359} O6 5909 0.0 -1 14 {} Si 0.0 {0.592645 0.583412 0.421431} Si7 5910 0.0 -1 8 {} O 0.0 {0.571005 0.599141 0.432378} O7 5911 0.0 -1 14 {} Si 0.0 {0.689455 0.588448 0.385112} Si8 5912 0.0 -1 7 {} N 0.0 {0.675603 0.594148 0.390076} N2 5913 0.0 -1 14 {} Si 0.0 {0.662014 0.585539 0.38919} Si9 5914 0.0 -1 14 {} Si 0.0 {0.690178 0.58687 0.350734} Si10 5915 0.0 -1 6 {} C 0.0 {0.621437 0.609138 0.282438} C3 5916 0.0 -1 7 {} N 0.0 {0.586909 0.592387 0.404359} N 5917 0.0 -1 8 {} O 0.0 {0.601016 0.591357 0.431995} O8 5918 0.0 -1 8 {} O 0.0 {0.676285 0.611887 0.433965} O9 5919 0.0 -1 8 {} O 0.0 {0.623621 0.633292 0.299354} O10 5920 0.0 -1 1 {} H 0.0 {0.697709 0.603802 0.38314} H18 5921 0.0 -1 1 {} H 0.0 {0.610763 0.587053 0.43245} H19 5922 0.0 -1 1 {} H 0.0 {0.665102 0.583247 0.366395} H20 5923 0.0 -1 1 {} H 0.0 {0.712706 0.563163 0.404696} H22 5924 0.0 -1 1 {} H 0.0 {0.734783 0.497696 0.496295} H24 5925 0.0 -1 1 {} H 0.0 {0.933694 0.0839199 0.541959} H25 5926 0.0 -1 1 {} H 0.0 {0.587267 0.520645 0.274965} H26 5927 0.0 -1 1 {} H 0.0 {0.640817 0.653273 0.310026} H27 5928 0.0 -1 1 {} H 0.0 {0.628849 0.605956 0.276085} H28 5929 0.0 -1 1 {} H 0.0 {0.591139 0.571295 0.393437} H29 5930 0.0 -1 1 {} H 0.0 {0.594877 0.598584 0.404062} H31 5931 0.0 -1 1 {} H 0.0 {0.623527 0.551867 0.383204} H32 5932 0.0 -1 1 {} H 0.0 {0.937448 0.0865246 0.535814} H33 5933 0.0 -1 1 {} H 0.0 {0.610574 0.654048 0.294918} H34 5934 0.0 -1 7 {} N 0.0 {0.659695 0.575486 0.404406} N3 5935 0.0 -1 1 {} H 0.0 {0.665162 0.567056 0.402614} H16 5936 0.0 -1 1 {} H 0.0 {0.649667 0.571713 0.403169} H17 5937 0.0 -1 7 {} N 0.0 {0.659814 0.576213 0.371776} N6 5938 0.0 -1 1 {} H 0.0 {0.177437 0.590925 0.485816} H41 5939 0.0 -1 1 {} H 0.0 {0.652865 0.58834 0.330355} H42 5940 0.0 -1 14 {} Si 0.0 {0.493275 0.204342 0.34853} Si6 5941 0.0 -1 8 {} O 0.0 {0.62019 0.431708 0.794764} O6 5942 0.0 -1 14 {} Si 0.0 {0.624358 0.455002 0.770621} Si7 5943 0.0 -1 8 {} O 0.0 {0.614211 0.450429 0.781745} O7 5944 0.0 -1 14 {} Si 0.0 {0.607183 0.437989 0.788465} Si8 5945 0.0 -1 7 {} N 0.0 {0.590738 0.446306 0.797412} N2 5946 0.0 -1 14 {} Si 0.0 {0.598269 0.461066 0.808905} Si9 5947 0.0 -1 14 {} Si 0.0 {0.578074 0.451157 0.811474} Si10 5948 0.0 -1 6 {} C 0.0 {0.483279 0.191959 0.346973} C3 5949 0.0 -1 7 {} N 0.0 {0.376266 0.26482 0.493994} N 5950 0.0 -1 8 {} O 0.0 {0.627239 0.441491 0.763333} O8 5951 0.0 -1 8 {} O 0.0 {0.609095 0.652575 0.533973} O9 5952 0.0 -1 8 {} O 0.0 {0.802818 0.43689 0.527971} O10 5953 0.0 -1 1 {} H 0.0 {0.580526 0.395501 0.789071} H18 5954 0.0 -1 1 {} H 0.0 {0.479444 0.574651 0.563853} H19 5955 0.0 -1 1 {} H 0.0 {0.613656 0.453334 0.739285} H20 5956 0.0 -1 1 {} H 0.0 {0.624693 0.426117 0.788475} H22 5957 0.0 -1 1 {} H 0.0 {0.457159 0.252159 0.4114} H24 5958 0.0 -1 1 {} H 0.0 {0.585412 0.464472 0.817976} H25 5959 0.0 -1 1 {} H 0.0 {0.487193 0.182681 0.350767} H26 5960 0.0 -1 1 {} H 0.0 {0.475118 0.192239 0.34081} H27 5961 0.0 -1 1 {} H 0.0 {0.393448 0.35968 0.332033} H28 5962 0.0 -1 1 {} H 0.0 {0.380331 0.255612 0.491033} H29 5963 0.0 -1 1 {} H 0.0 {0.378244 0.271327 0.486095} H31 5964 0.0 -1 1 {} H 0.0 {0.59536 0.390539 0.791943} H32 5965 0.0 -1 1 {} H 0.0 {0.495073 0.209712 0.33348} H33 5966 0.0 -1 1 {} H 0.0 {0.806429 0.445655 0.525355} H34 5967 0.0 -1 7 {} N 0.0 {0.610985 0.454529 0.818397} N3 5968 0.0 -1 1 {} H 0.0 {0.617462 0.46206 0.820158} H16 5969 0.0 -1 1 {} H 0.0 {0.616336 0.449502 0.811337} H17 5970 0.0 -1 7 {} N 0.0 {0.573609 0.438571 0.822857} N6 5971 0.0 -1 1 {} H 0.0 {0.572791 0.430174 0.817158} H41 5972 0.0 -1 1 {} H 0.0 {0.581261 0.437349 0.829587} H42 5973 0.0 -1 14 {} Si 0.0 {0.586407 0.596824 0.518676} Si6 5974 0.0 -1 8 {} O 0.0 {0.584161 0.607305 0.530188} O6 5975 0.0 -1 14 {} Si 0.0 {0.587149 0.621186 0.537766} Si7 5976 0.0 -1 8 {} O 0.0 {0.571491 0.625081 0.540773} O7 5977 0.0 -1 14 {} Si 0.0 {0.557912 0.627429 0.533473} Si8 5978 0.0 -1 7 {} N 0.0 {0.550592 0.618118 0.522284} N2 5979 0.0 -1 14 {} Si 0.0 {0.532519 0.610022 0.520868} Si9 5980 0.0 -1 14 {} Si 0.0 {0.554897 0.612126 0.508017} Si10 5981 0.0 -1 6 {} C 0.0 {0.601318 0.595768 0.507358} C3 5982 0.0 -1 7 {} N 0.0 {0.596121 0.62164 0.555047} N 5983 0.0 -1 8 {} O 0.0 {0.590356 0.63146 0.525008} O8 5984 0.0 -1 8 {} O 0.0 {0.582328 0.612956 0.504879} O9 5985 0.0 -1 8 {} O 0.0 {0.568607 0.587552 0.514621} O10 5986 0.0 -1 1 {} H 0.0 {0.478799 0.599165 0.582834} H18 5987 0.0 -1 1 {} H 0.0 {0.557609 0.641569 0.526755} H19 5988 0.0 -1 1 {} H 0.0 {0.523938 0.601865 0.535584} H20 5989 0.0 -1 1 {} H 0.0 {0.532554 0.618682 0.537809} H22 5990 0.0 -1 1 {} H 0.0 {0.562842 0.597314 0.511282} H24 5991 0.0 -1 1 {} H 0.0 {0.571858 0.612892 0.506339} H25 5992 0.0 -1 1 {} H 0.0 {0.599974 0.603665 0.499334} H26 5993 0.0 -1 1 {} H 0.0 {0.601203 0.585804 0.503434} H27 5994 0.0 -1 1 {} H 0.0 {0.610018 0.59798 0.513595} H28 5995 0.0 -1 1 {} H 0.0 {0.605458 0.617832 0.553295} H29 5996 0.0 -1 1 {} H 0.0 {0.590633 0.615572 0.56098} H31 5997 0.0 -1 1 {} H 0.0 {0.582247 0.637659 0.524368} H32 5998 0.0 -1 1 {} H 0.0 {0.586211 0.620652 0.510378} H33 5999 0.0 -1 1 {} H 0.0 {0.564835 0.585663 0.523962} H34 6000 0.0 -1 7 {} N 0.0 {0.530223 0.59128 0.514954} N3 6001 0.0 -1 1 {} H 0.0 {0.538922 0.587132 0.518} H16 6002 0.0 -1 1 {} H 0.0 {0.522968 0.587921 0.520984} H17 6003 0.0 -1 7 {} N 0.0 {0.548602 0.624024 0.493218} N6 6004 0.0 -1 1 {} H 0.0 {0.555591 0.620277 0.485522} H41 6005 0.0 -1 1 {} H 0.0 {0.540379 0.619232 0.490929} H42 6006 0.0 -1 14 {} Si 0.0 {0.598028 0.64359 0.271173} Si6 6007 0.0 -1 8 {} O 0.0 {0.676614 0.595905 0.351012} O6 6008 0.0 -1 14 {} Si 0.0 {0.67208 0.611892 0.350246} Si7 6009 0.0 -1 8 {} O 0.0 {0.713849 0.586772 0.414062} O7 6010 0.0 -1 14 {} Si 0.0 {0.704266 0.575729 0.408657} Si8 6011 0.0 -1 7 {} N 0.0 {0.647159 0.597118 0.331256} N2 6012 0.0 -1 14 {} Si 0.0 {0.65352 0.611375 0.327075} Si9 6013 0.0 -1 14 {} Si 0.0 {0.533804 0.624718 0.701538} Si10 6014 0.0 -1 6 {} C 0.0 {0.697571 0.580554 0.3653} C3 6015 0.0 -1 7 {} N 0.0 {0.360387 0.562006 0.319538} N 6016 0.0 -1 8 {} O 0.0 {0.686537 0.614224 0.343452} O8 6017 0.0 -1 8 {} O 0.0 {0.588001 0.636197 0.262111} O9 6018 0.0 -1 8 {} O 0.0 {0.609725 0.598186 0.28761} O10 6019 0.0 -1 1 {} H 0.0 {0.695972 0.570471 0.36714} H18 6020 0.0 -1 1 {} H 0.0 {0.697261 0.582222 0.397021} H19 6021 0.0 -1 1 {} H 0.0 {0.662495 0.612384 0.33903} H20 6022 0.0 -1 1 {} H 0.0 {0.662631 0.614346 0.315457} H22 6023 0.0 -1 1 {} H 0.0 {0.532245 0.637407 0.693871} H24 6024 0.0 -1 1 {} H 0.0 {0.51898 0.630863 0.702916} H25 6025 0.0 -1 1 {} H 0.0 {0.707595 0.584565 0.36591} H26 6026 0.0 -1 1 {} H 0.0 {0.675797 0.615699 0.424628} H27 6027 0.0 -1 1 {} H 0.0 {0.699983 0.62201 0.380328} H28 6028 0.0 -1 1 {} H 0.0 {0.362401 0.555208 0.327314} H29 6029 0.0 -1 1 {} H 0.0 {0.352177 0.556697 0.314936} H31 6030 0.0 -1 1 {} H 0.0 {0.704235 0.618613 0.357485} H32 6031 0.0 -1 1 {} H 0.0 {0.590274 0.639161 0.253329} H33 6032 0.0 -1 1 {} H 0.0 {0.583345 0.596089 0.334701} H34 6033 0.0 -1 7 {} N 0.0 {0.544108 0.626286 0.714965} N3 6034 0.0 -1 1 {} H 0.0 {0.539215 0.627218 0.724059} H16 6035 0.0 -1 1 {} H 0.0 {0.550193 0.617755 0.716148} H17 6036 0.0 -1 7 {} N 0.0 {0.667037 0.617561 0.369467} N6 6037 0.0 -1 1 {} H 0.0 {0.66805 0.608588 0.374387} H41 6038 0.0 -1 1 {} H 0.0 {0.65648 0.619399 0.369297} H42 6039 0.0 -1 14 {} Si 0.0 {0.606146 0.249494 0.552079} Si6 6040 0.0 -1 8 {} O 0.0 {0.60067 0.26875 0.555112} O6 6041 0.0 -1 14 {} Si 0.0 {0.456944 0.655364 0.381769} Si7 6042 0.0 -1 8 {} O 0.0 {0.467965 0.647524 0.375156} O7 6043 0.0 -1 14 {} Si 0.0 {0.470772 0.635132 0.365887} Si8 6044 0.0 -1 7 {} N 0.0 {0.466004 0.631475 0.346727} N2 6045 0.0 -1 14 {} Si 0.0 {0.459319 0.64922 0.345034} Si9 6046 0.0 -1 14 {} Si 0.0 {0.45768 0.61752 0.341106} Si10 6047 0.0 -1 6 {} C 0.0 {0.59892 0.238435 0.541316} C3 6048 0.0 -1 7 {} N 0.0 {0.459394 0.664722 0.399337} N 6049 0.0 -1 8 {} O 0.0 {0.457556 0.669754 0.368283} O8 6050 0.0 -1 8 {} O 0.0 {0.61355 0.247167 0.566412} O9 6051 0.0 -1 8 {} O 0.0 {0.653907 0.256777 0.498102} O10 6052 0.0 -1 1 {} H 0.0 {0.487049 0.632353 0.365356} H18 6053 0.0 -1 1 {} H 0.0 {0.465339 0.623854 0.373292} H19 6054 0.0 -1 1 {} H 0.0 {0.457882 0.661172 0.357555} H20 6055 0.0 -1 1 {} H 0.0 {0.652101 0.249068 0.491815} H22 6056 0.0 -1 1 {} H 0.0 {0.462387 0.615035 0.32756} H24 6057 0.0 -1 1 {} H 0.0 {0.443457 0.618891 0.340823} H25 6058 0.0 -1 1 {} H 0.0 {0.606927 0.233935 0.53539} H26 6059 0.0 -1 1 {} H 0.0 {0.593816 0.231215 0.546864} H27 6060 0.0 -1 1 {} H 0.0 {0.607497 0.273659 0.550379} H28 6061 0.0 -1 1 {} H 0.0 {0.459953 0.658914 0.407924} H29 6062 0.0 -1 1 {} H 0.0 {0.468998 0.668827 0.39773} H31 6063 0.0 -1 1 {} H 0.0 {0.466448 0.673969 0.369455} H32 6064 0.0 -1 1 {} H 0.0 {0.612097 0.237968 0.568593} H33 6065 0.0 -1 1 {} H 0.0 {0.650569 0.251402 0.505955} H34 6066 0.0 -1 7 {} N 0.0 {0.466154 0.65834 0.333974} N3 6067 0.0 -1 1 {} H 0.0 {0.357966 0.585096 0.335057} H16 6068 0.0 -1 1 {} H 0.0 {0.469441 0.652065 0.326901} H17 6069 0.0 -1 7 {} N 0.0 {0.463396 0.601839 0.349908} N6 6070 0.0 -1 1 {} H 0.0 {0.470071 0.599796 0.341986} H41 6071 0.0 -1 1 {} H 0.0 {0.469263 0.607007 0.356474} H42 6072 0.0 -1 14 {} Si 0.0 {0.590848 0.499094 0.740691} Si6 6073 0.0 -1 8 {} O 0.0 {0.594767 0.51157 0.732027} O6 6074 0.0 -1 14 {} Si 0.0 {0.593074 0.483861 0.714482} Si7 6075 0.0 -1 8 {} O 0.0 {0.582597 0.49404 0.707837} O7 6076 0.0 -1 14 {} Si 0.0 {0.566618 0.495647 0.702787} Si8 6077 0.0 -1 7 {} N 0.0 {0.553664 0.49573 0.712538} N2 6078 0.0 -1 14 {} Si 0.0 {0.555994 0.488819 0.727122} Si9 6079 0.0 -1 14 {} Si 0.0 {0.602139 0.543208 0.687818} Si10 6080 0.0 -1 6 {} C 0.0 {0.265629 0.309488 0.568447} C3 6081 0.0 -1 7 {} N 0.0 {0.608395 0.482231 0.703585} N 6082 0.0 -1 8 {} O 0.0 {0.591282 0.48895 0.729578} O8 6083 0.0 -1 8 {} O 0.0 {0.606471 0.498198 0.754349} O9 6084 0.0 -1 8 {} O 0.0 {0.576725 0.503919 0.744776} O10 6085 0.0 -1 1 {} H 0.0 {0.567416 0.512136 0.695486} H18 6086 0.0 -1 1 {} H 0.0 {0.563216 0.485765 0.689838} H19 6087 0.0 -1 1 {} H 0.0 {0.566669 0.495996 0.73553} H20 6088 0.0 -1 1 {} H 0.0 {0.560933 0.473821 0.723435} H22 6089 0.0 -1 1 {} H 0.0 {0.547381 0.504403 0.713341} H24 6090 0.0 -1 1 {} H 0.0 {0.614537 0.550101 0.692439} H25 6091 0.0 -1 1 {} H 0.0 {0.258258 0.304564 0.574206} H26 6092 0.0 -1 1 {} H 0.0 {0.273896 0.303914 0.564827} H27 6093 0.0 -1 1 {} H 0.0 {0.258894 0.311621 0.560604} H28 6094 0.0 -1 1 {} H 0.0 {0.613192 0.491105 0.704437} H29 6095 0.0 -1 1 {} H 0.0 {0.613806 0.476062 0.710092} H31 6096 0.0 -1 1 {} H 0.0 {0.593582 0.509862 0.722637} H32 6097 0.0 -1 1 {} H 0.0 {0.592164 0.495336 0.767268} H33 6098 0.0 -1 1 {} H 0.0 {0.322644 0.32669 0.507839} H34 6099 0.0 -1 7 {} N 0.0 {0.538813 0.489942 0.736445} N3 6100 0.0 -1 1 {} H 0.0 {0.533358 0.483286 0.730867} H16 6101 0.0 -1 1 {} H 0.0 {0.535043 0.499204 0.733112} H17 6102 0.0 -1 7 {} N 0.0 {0.59313 0.540501 0.646144} N6 6103 0.0 -1 1 {} H 0.0 {0.597711 0.543685 0.637697} H41 6104 0.0 -1 1 {} H 0.0 {0.615109 0.511581 0.677628} H42 6105 0.0 -1 14 {} Si 0.0 {0.217185 0.458571 0.568903} Si6 6106 0.0 -1 8 {} O 0.0 {0.58516 0.38862 0.794578} O6 6107 0.0 -1 14 {} Si 0.0 {0.2247 0.474334 0.551109} Si7 6108 0.0 -1 8 {} O 0.0 {0.600692 0.511668 0.645027} O7 6109 0.0 -1 14 {} Si 0.0 {0.72108 0.551745 0.400734} Si8 6110 0.0 -1 7 {} N 0.0 {0.412356 0.335396 0.262931} N2 6111 0.0 -1 14 {} Si 0.0 {0.720984 0.536223 0.422556} Si9 6112 0.0 -1 14 {} Si 0.0 {0.423378 0.339834 0.276995} Si10 6113 0.0 -1 6 {} C 0.0 {0.409716 0.374932 0.247972} C3 6114 0.0 -1 7 {} N 0.0 {0.218085 0.490889 0.545467} N 6115 0.0 -1 8 {} O 0.0 {0.236239 0.466725 0.567097} O8 6116 0.0 -1 8 {} O 0.0 {0.203844 0.466687 0.565087} O9 6117 0.0 -1 8 {} O 0.0 {0.506483 0.496179 0.778892} O10 6118 0.0 -1 1 {} H 0.0 {0.645692 0.599076 0.442679} H18 6119 0.0 -1 1 {} H 0.0 {0.735525 0.55605 0.400099} H19 6120 0.0 -1 1 {} H 0.0 {0.721299 0.544286 0.411171} H20 6121 0.0 -1 1 {} H 0.0 {0.725963 0.521215 0.419089} H22 6122 0.0 -1 1 {} H 0.0 {0.668017 0.588162 0.501482} H24 6123 0.0 -1 1 {} H 0.0 {0.387822 0.414071 0.315426} H25 6124 0.0 -1 1 {} H 0.0 {0.430304 0.374945 0.326821} H26 6125 0.0 -1 1 {} H 0.0 {0.400623 0.37724 0.243295} H27 6126 0.0 -1 1 {} H 0.0 {0.417261 0.371699 0.24101} H28 6127 0.0 -1 1 {} H 0.0 {0.225459 0.49645 0.542987} H29 6128 0.0 -1 1 {} H 0.0 {0.2132 0.495606 0.553397} H31 6129 0.0 -1 1 {} H 0.0 {0.236476 0.474109 0.57364} H32 6130 0.0 -1 1 {} H 0.0 {0.206779 0.474525 0.556843} H33 6131 0.0 -1 1 {} H 0.0 {0.393454 0.235102 0.482119} H34 6132 0.0 -1 7 {} N 0.0 {0.727641 0.543367 0.436428} N3 6133 0.0 -1 1 {} H 0.0 {0.721422 0.540584 0.443304} H16 6134 0.0 -1 1 {} H 0.0 {0.736376 0.53886 0.438217} H17 6135 0.0 -1 7 {} N 0.0 {0.436351 0.35198 0.269231} N6 6136 0.0 -1 1 {} H 0.0 {0.431975 0.355501 0.260627} H41 6137 0.0 -1 1 {} H 0.0 {0.436075 0.35988 0.275694} H42 6138 0.0 -1 14 {} Si 0.0 {0.280493 0.588856 0.402977} Si6 6139 0.0 -1 8 {} O 0.0 {0.267098 0.583344 0.395076} O6 6140 0.0 -1 14 {} Si 0.0 {0.600733 0.694269 0.477174} Si7 6141 0.0 -1 8 {} O 0.0 {0.283053 0.659453 0.516958} O7 6142 0.0 -1 14 {} Si 0.0 {0.276607 0.651585 0.50747} Si8 6143 0.0 -1 7 {} N 0.0 {0.630082 0.357706 0.73422} N2 6144 0.0 -1 14 {} Si 0.0 {0.63201 0.346314 0.722378} Si9 6145 0.0 -1 14 {} Si 0.0 {0.621106 0.365589 0.745148} Si10 6146 0.0 -1 6 {} C 0.0 {0.29583 0.57783 0.405789} C3 6147 0.0 -1 7 {} N 0.0 {0.645215 0.339511 0.717441} N 6148 0.0 -1 8 {} O 0.0 {0.585703 0.69631 0.480372} O8 6149 0.0 -1 8 {} O 0.0 {0.269784 0.593678 0.419491} O9 6150 0.0 -1 8 {} O 0.0 {0.283498 0.60483 0.39876} O10 6151 0.0 -1 1 {} H 0.0 {0.276015 0.656588 0.493072} H18 6152 0.0 -1 1 {} H 0.0 {0.38832 0.29024 0.504484} H19 6153 0.0 -1 1 {} H 0.0 {0.3291 0.283418 0.554824} H20 6154 0.0 -1 1 {} H 0.0 {0.41747 0.327867 0.257548} H22 6155 0.0 -1 1 {} H 0.0 {0.497359 0.758426 0.511488} H24 6156 0.0 -1 1 {} H 0.0 {0.62928 0.358014 0.759204} H25 6157 0.0 -1 1 {} H 0.0 {0.301803 0.583302 0.412576} H26 6158 0.0 -1 1 {} H 0.0 {0.301263 0.577629 0.39663} H27 6159 0.0 -1 1 {} H 0.0 {0.291645 0.568865 0.40859} H28 6160 0.0 -1 1 {} H 0.0 {0.583761 0.598367 0.266776} H29 6161 0.0 -1 1 {} H 0.0 {0.651644 0.336375 0.724486} H31 6162 0.0 -1 1 {} H 0.0 {0.584041 0.704215 0.473481} H32 6163 0.0 -1 1 {} H 0.0 {0.274472 0.592808 0.428843} H33 6164 0.0 -1 1 {} H 0.0 {0.274258 0.608665 0.398532} H34 6165 0.0 -1 7 {} N 0.0 {0.387582 0.296502 0.49619} N3 6166 0.0 -1 1 {} H 0.0 {0.670103 0.458716 0.607209} H16 6167 0.0 -1 1 {} H 0.0 {0.377915 0.296141 0.493018} H17 6168 0.0 -1 7 {} N 0.0 {0.36428 0.586543 0.343362} N6 6169 0.0 -1 1 {} H 0.0 {0.373281 0.581723 0.34253} H41 6170 0.0 -1 1 {} H 0.0 {0.607136 0.362122 0.741566} H42 6171 0.0 -1 14 {} Si 0.0 {0.487158 0.244288 0.614443} Si6 6172 0.0 -1 8 {} O 0.0 {0.496312 0.239227 0.626023} O6 6173 0.0 -1 14 {} Si 0.0 {0.489599 0.248986 0.637566} Si7 6174 0.0 -1 8 {} O 0.0 {0.413742 0.641715 0.480999} O7 6175 0.0 -1 14 {} Si 0.0 {0.504883 0.253609 0.599696} Si8 6176 0.0 -1 7 {} N 0.0 {0.522236 0.263318 0.598417} N2 6177 0.0 -1 14 {} Si 0.0 {0.517437 0.264205 0.617323} Si9 6178 0.0 -1 14 {} Si 0.0 {0.534733 0.276882 0.604697} Si10 6179 0.0 -1 6 {} C 0.0 {0.37725 0.66373 0.488084} C3 6180 0.0 -1 7 {} N 0.0 {0.476277 0.251378 0.653675} N 6181 0.0 -1 8 {} O 0.0 {0.492565 0.263383 0.596543} O8 6182 0.0 -1 8 {} O 0.0 {0.486465 0.260492 0.627874} O9 6183 0.0 -1 8 {} O 0.0 {0.589318 0.281222 0.59143} O10 6184 0.0 -1 1 {} H 0.0 {0.373457 0.644748 0.389259} H18 6185 0.0 -1 1 {} H 0.0 {0.506211 0.253408 0.615654} H19 6186 0.0 -1 1 {} H 0.0 {0.509766 0.27433 0.624797} H20 6187 0.0 -1 1 {} H 0.0 {0.403542 0.955238 0.998436} H22 6188 0.0 -1 1 {} H 0.0 {0.544621 0.277448 0.592323} H24 6189 0.0 -1 1 {} H 0.0 {0.545309 0.2741 0.616536} H25 6190 0.0 -1 1 {} H 0.0 {0.377944 0.655273 0.481949} H26 6191 0.0 -1 1 {} H 0.0 {0.375503 0.672198 0.48176} H27 6192 0.0 -1 1 {} H 0.0 {0.385548 0.663836 0.495424} H28 6193 0.0 -1 1 {} H 0.0 {0.643949 0.500363 0.336549} H29 6194 0.0 -1 1 {} H 0.0 {0.471883 0.249767 0.662811} H31 6195 0.0 -1 1 {} H 0.0 {0.491653 0.268716 0.60447} H32 6196 0.0 -1 1 {} H 0.0 {0.469172 0.254304 0.647519} H33 6197 0.0 -1 1 {} H 0.0 {0.598103 0.276805 0.592554} H34 6198 0.0 -1 7 {} N 0.0 {0.527084 0.236206 0.6367} N3 6199 0.0 -1 1 {} H 0.0 {0.526757 0.236249 0.647054} H16 6200 0.0 -1 1 {} H 0.0 {0.517737 0.235236 0.633695} H17 6201 0.0 -1 7 {} N 0.0 {0.529488 0.294961 0.60778} N6 6202 0.0 -1 1 {} H 0.0 {0.520707 0.295023 0.602173} H41 6203 0.0 -1 1 {} H 0.0 {0.536358 0.299789 0.602408} H42 6204 0.0 -1 14 {} Si 0.0 {0.227029 0.354301 0.573392} Si6 6205 0.0 -1 8 {} O 0.0 {0.211382 0.353303 0.576166} O6 6206 0.0 -1 14 {} Si 0.0 {0.268634 0.359086 0.613191} Si7 6207 0.0 -1 8 {} O 0.0 {0.25774 0.367574 0.604791} O7 6208 0.0 -1 14 {} Si 0.0 {0.256961 0.364776 0.589724} Si8 6209 0.0 -1 7 {} N 0.0 {0.352759 0.407018 0.636723} N2 6210 0.0 -1 14 {} Si 0.0 {0.208612 0.509353 0.613803} Si9 6211 0.0 -1 14 {} Si 0.0 {0.339669 0.420334 0.638003} Si10 6212 0.0 -1 6 {} C 0.0 {0.238658 0.342419 0.569555} C3 6213 0.0 -1 7 {} N 0.0 {0.261452 0.354409 0.630147} N 6214 0.0 -1 8 {} O 0.0 {0.279096 0.370444 0.611905} O8 6215 0.0 -1 8 {} O 0.0 {0.229301 0.366515 0.583578} O9 6216 0.0 -1 8 {} O 0.0 {0.229322 0.365017 0.554949} O10 6217 0.0 -1 1 {} H 0.0 {0.239649 0.365838 0.585946} H18 6218 0.0 -1 1 {} H 0.0 {0.25156 0.34999 0.586217} H19 6219 0.0 -1 1 {} H 0.0 {0.20492 0.529287 0.647693} H20 6220 0.0 -1 1 {} H 0.0 {0.201859 0.523334 0.608732} H22 6221 0.0 -1 1 {} H 0.0 {0.472682 0.371219 0.30352} H24 6222 0.0 -1 1 {} H 0.0 {0.56153 0.444771 0.478581} H25 6223 0.0 -1 1 {} H 0.0 {0.232912 0.333266 0.567629} H26 6224 0.0 -1 1 {} H 0.0 {0.244948 0.345956 0.561178} H27 6225 0.0 -1 1 {} H 0.0 {0.239333 0.350407 0.61339} H28 6226 0.0 -1 1 {} H 0.0 {0.255314 0.362593 0.631315} H29 6227 0.0 -1 1 {} H 0.0 {0.269074 0.356428 0.636669} H31 6228 0.0 -1 1 {} H 0.0 {0.281662 0.370859 0.602087} H32 6229 0.0 -1 1 {} H 0.0 {0.523212 0.54065 0.80325} H33 6230 0.0 -1 1 {} H 0.0 {0.23785 0.362294 0.550767} H34 6231 0.0 -1 7 {} N 0.0 {0.195337 0.510839 0.627017} N3 6232 0.0 -1 1 {} H 0.0 {0.201193 0.506877 0.634278} H16 6233 0.0 -1 1 {} H 0.0 {0.610156 0.700401 0.489861} H17 6234 0.0 -1 7 {} N 0.0 {0.329884 0.41473 0.654234} N6 6235 0.0 -1 1 {} H 0.0 {0.32094 0.4157 0.650451} H41 6236 0.0 -1 1 {} H 0.0 {0.332958 0.405376 0.65434} H42 6237 0.0 -1 14 {} Si 0.0 {0.66864 0.516336 0.433829} Si6 6238 0.0 -1 8 {} O 0.0 {0.65779 0.505335 0.430526} O6 6239 0.0 -1 14 {} Si 0.0 {0.655809 0.493379 0.420847} Si7 6240 0.0 -1 8 {} O 0.0 {0.669238 0.485915 0.42301} O7 6241 0.0 -1 14 {} Si 0.0 {0.681652 0.476921 0.421398} Si8 6242 0.0 -1 7 {} N 0.0 {0.69719 0.478866 0.408816} N2 6243 0.0 -1 14 {} Si 0.0 {0.696041 0.497571 0.416383} Si9 6244 0.0 -1 14 {} Si 0.0 {0.71589 0.483769 0.407026} Si10 6245 0.0 -1 6 {} C 0.0 {0.706563 0.47405 0.361297} C3 6246 0.0 -1 7 {} N 0.0 {0.639194 0.485447 0.419119} N 6247 0.0 -1 8 {} O 0.0 {0.650859 0.472691 0.381936} O8 6248 0.0 -1 8 {} O 0.0 {0.675551 0.522841 0.421043} O9 6249 0.0 -1 8 {} O 0.0 {0.662018 0.529647 0.452215} O10 6250 0.0 -1 1 {} H 0.0 {0.687164 0.476136 0.435945} H18 6251 0.0 -1 1 {} H 0.0 {0.675669 0.461645 0.42} H19 6252 0.0 -1 1 {} H 0.0 {0.719982 0.505253 0.408858} H20 6253 0.0 -1 1 {} H 0.0 {0.68397 0.501479 0.424591} H22 6254 0.0 -1 1 {} H 0.0 {0.722581 0.468896 0.4078} H24 6255 0.0 -1 1 {} H 0.0 {0.351607 0.521007 0.659028} H25 6256 0.0 -1 1 {} H 0.0 {0.693201 0.480229 0.399447} H26 6257 0.0 -1 1 {} H 0.0 {0.702345 0.464861 0.362824} H27 6258 0.0 -1 1 {} H 0.0 {0.654153 0.48158 0.385354} H28 6259 0.0 -1 1 {} H 0.0 {0.636924 0.481818 0.42811} H29 6260 0.0 -1 1 {} H 0.0 {0.633196 0.493414 0.41797} H31 6261 0.0 -1 1 {} H 0.0 {0.646698 0.469296 0.389546} H32 6262 0.0 -1 1 {} H 0.0 {0.674272 0.532563 0.421523} H33 6263 0.0 -1 1 {} H 0.0 {0.659443 0.535209 0.460877} H34 6264 0.0 -1 7 {} N 0.0 {0.698079 0.50919 0.401387} N3 6265 0.0 -1 1 {} H 0.0 {0.689158 0.514344 0.399989} H16 6266 0.0 -1 1 {} H 0.0 {0.698098 0.503287 0.393607} H17 6267 0.0 -1 7 {} N 0.0 {0.607958 0.224436 0.512292} N6 6268 0.0 -1 1 {} H 0.0 {0.719021 0.483634 0.434317} H41 6269 0.0 -1 1 {} H 0.0 {0.59884 0.219359 0.513225} H42 6270 0.0 -1 14 {} Si 0.0 {0.566131 0.307384 0.515789} Si6 6271 0.0 -1 8 {} O 0.0 {0.571244 0.294396 0.508035} O6 6272 0.0 -1 14 {} Si 0.0 {0.569288 0.282789 0.497447} Si7 6273 0.0 -1 8 {} O 0.0 {0.571072 0.29252 0.484099} O7 6274 0.0 -1 14 {} Si 0.0 {0.582677 0.298787 0.475614} Si8 6275 0.0 -1 7 {} N 0.0 {0.602226 0.294417 0.479803} N2 6276 0.0 -1 14 {} Si 0.0 {0.622506 0.292561 0.480254} Si9 6277 0.0 -1 14 {} Si 0.0 {0.602966 0.302568 0.49758} Si10 6278 0.0 -1 6 {} C 0.0 {0.548927 0.311979 0.520836} C3 6279 0.0 -1 7 {} N 0.0 {0.578623 0.265058 0.497511} N 6280 0.0 -1 8 {} O 0.0 {0.554004 0.276962 0.500719} O8 6281 0.0 -1 8 {} O 0.0 {0.575753 0.316813 0.508263} O9 6282 0.0 -1 8 {} O 0.0 {0.581212 0.302097 0.529247} O10 6283 0.0 -1 1 {} H 0.0 {0.579698 0.292428 0.463157} H18 6284 0.0 -1 1 {} H 0.0 {0.57951 0.313027 0.473859} H19 6285 0.0 -1 1 {} H 0.0 {0.336807 0.794955 0.108706} H20 6286 0.0 -1 1 {} H 0.0 {0.59982 0.285543 0.483102} H22 6287 0.0 -1 1 {} H 0.0 {0.587402 0.307585 0.498264} H24 6288 0.0 -1 1 {} H 0.0 {0.658884 0.294876 0.441174} H25 6289 0.0 -1 1 {} H 0.0 {0.543435 0.302285 0.521847} H26 6290 0.0 -1 1 {} H 0.0 {0.544508 0.318171 0.513027} H27 6291 0.0 -1 1 {} H 0.0 {0.549561 0.317745 0.530024} H28 6292 0.0 -1 1 {} H 0.0 {0.575041 0.260645 0.489634} H29 6293 0.0 -1 1 {} H 0.0 {0.575615 0.259183 0.505475} H31 6294 0.0 -1 1 {} H 0.0 {0.554644 0.267403 0.498473} H32 6295 0.0 -1 1 {} H 0.0 {0.570451 0.321737 0.501477} H33 6296 0.0 -1 1 {} H 0.0 {0.588456 0.298267 0.522254} H34 6297 0.0 -1 7 {} N 0.0 {0.57192 0.33716 0.455217} N3 6298 0.0 -1 1 {} H 0.0 {0.564299 0.344195 0.456618} H16 6299 0.0 -1 1 {} H 0.0 {0.655347 0.279881 0.508706} H17 6300 0.0 -1 7 {} N 0.0 {0.604979 0.289965 0.511495} N6 6301 0.0 -1 1 {} H 0.0 {0.599695 0.282703 0.507219} H41 6302 0.0 -1 1 {} H 0.0 {0.614464 0.288036 0.514383} H42 6303 0.0 -1 14 {} Si 0.0 {0.487137 0.406124 0.367518} Si6 6304 0.0 -1 8 {} O 0.0 {0.482149 0.392731 0.37358} O6 6305 0.0 -1 14 {} Si 0.0 {0.483277 0.37686 0.375527} Si7 6306 0.0 -1 8 {} O 0.0 {0.483505 0.370874 0.361021} O7 6307 0.0 -1 14 {} Si 0.0 {0.479179 0.370175 0.346105} Si8 6308 0.0 -1 7 {} N 0.0 {0.483963 0.37151 0.327121} N2 6309 0.0 -1 14 {} Si 0.0 {0.473106 0.36731 0.316401} Si9 6310 0.0 -1 14 {} Si 0.0 {0.500566 0.376989 0.318511} Si10 6311 0.0 -1 6 {} C 0.0 {0.476031 0.41603 0.356883} C3 6312 0.0 -1 7 {} N 0.0 {0.496926 0.369201 0.387204} N 6313 0.0 -1 8 {} O 0.0 {0.467226 0.376063 0.379229} O8 6314 0.0 -1 8 {} O 0.0 {0.500429 0.400592 0.362001} O9 6315 0.0 -1 8 {} O 0.0 {0.493667 0.417212 0.384065} O10 6316 0.0 -1 1 {} H 0.0 {0.475098 0.357655 0.346544} H18 6317 0.0 -1 1 {} H 0.0 {0.469374 0.382005 0.345148} H19 6318 0.0 -1 1 {} H 0.0 {0.467947 0.350903 0.314995} H20 6319 0.0 -1 1 {} H 0.0 {0.446258 0.313063 0.354466} H22 6320 0.0 -1 1 {} H 0.0 {0.543698 0.381614 0.33223} H24 6321 0.0 -1 1 {} H 0.0 {0.500664 0.372977 0.305061} H25 6322 0.0 -1 1 {} H 0.0 {0.482481 0.421528 0.350752} H26 6323 0.0 -1 1 {} H 0.0 {0.471088 0.424548 0.362122} H27 6324 0.0 -1 1 {} H 0.0 {0.468838 0.409381 0.352245} H28 6325 0.0 -1 1 {} H 0.0 {0.491192 0.361091 0.39016} H29 6326 0.0 -1 1 {} H 0.0 {0.503647 0.364886 0.381125} H31 6327 0.0 -1 1 {} H 0.0 {0.462363 0.374088 0.371459} H32 6328 0.0 -1 1 {} H 0.0 {0.507992 0.40057 0.369206} H33 6329 0.0 -1 1 {} H 0.0 {0.490065 0.411153 0.391857} H34 6330 0.0 -1 7 {} N 0.0 {0.456808 0.370282 0.324425} N3 6331 0.0 -1 1 {} H 0.0 {0.456058 0.379222 0.328771} H16 6332 0.0 -1 1 {} H 0.0 {0.450172 0.36996 0.316349} H17 6333 0.0 -1 7 {} N 0.0 {0.515225 0.391488 0.325685} N6 6334 0.0 -1 1 {} H 0.0 {0.522811 0.385059 0.324113} H41 6335 0.0 -1 1 {} H 0.0 {0.512438 0.389891 0.335374} H42 6336 0.0 -1 14 {} Si 0.0 {0.664577 0.409941 0.366571} Si6 6337 0.0 -1 8 {} O 0.0 {0.635893 0.413768 0.342577} O6 6338 0.0 -1 14 {} Si 0.0 {0.603042 0.399276 0.399954} Si7 6339 0.0 -1 8 {} O 0.0 {0.606089 0.411018 0.390305} O7 6340 0.0 -1 14 {} Si 0.0 {0.613181 0.424037 0.385521} Si8 6341 0.0 -1 7 {} N 0.0 {0.629559 0.424861 0.375197} N2 6342 0.0 -1 14 {} Si 0.0 {0.624913 0.410627 0.367919} Si9 6343 0.0 -1 14 {} Si 0.0 {0.644911 0.428535 0.379412} Si10 6344 0.0 -1 6 {} C 0.0 {0.659556 0.40161 0.351622} C3 6345 0.0 -1 7 {} N 0.0 {0.608061 0.384841 0.395981} N 6346 0.0 -1 8 {} O 0.0 {0.615864 0.377205 0.480629} O8 6347 0.0 -1 8 {} O 0.0 {0.659047 0.405731 0.386185} O9 6348 0.0 -1 8 {} O 0.0 {0.671237 0.42458 0.366314} O10 6349 0.0 -1 1 {} H 0.0 {0.601486 0.432239 0.376202} H18 6350 0.0 -1 1 {} H 0.0 {0.615476 0.433097 0.399435} H19 6351 0.0 -1 1 {} H 0.0 {0.608892 0.408191 0.36132} H20 6352 0.0 -1 1 {} H 0.0 {0.632262 0.411919 0.352392} H22 6353 0.0 -1 1 {} H 0.0 {0.65437 0.431651 0.368646} H24 6354 0.0 -1 1 {} H 0.0 {0.65207 0.414947 0.384841} H25 6355 0.0 -1 1 {} H 0.0 {0.648725 0.410662 0.345531} H26 6356 0.0 -1 1 {} H 0.0 {0.654924 0.392062 0.353431} H27 6357 0.0 -1 1 {} H 0.0 {0.668248 0.400489 0.345448} H28 6358 0.0 -1 1 {} H 0.0 {0.605415 0.375283 0.396401} H29 6359 0.0 -1 1 {} H 0.0 {0.744874 0.0543369 0.62858} H31 6360 0.0 -1 1 {} H 0.0 {0.620315 0.370613 0.476666} H32 6361 0.0 -1 1 {} H 0.0 {0.652662 0.398161 0.383626} H33 6362 0.0 -1 1 {} H 0.0 {0.681823 0.423303 0.368273} H34 6363 0.0 -1 7 {} N 0.0 {0.632358 0.395296 0.374872} N3 6364 0.0 -1 1 {} H 0.0 {0.63071 0.388041 0.367928} H16 6365 0.0 -1 1 {} H 0.0 {0.626791 0.39292 0.383037} H17 6366 0.0 -1 7 {} N 0.0 {0.6454 0.44266 0.393758} N6 6367 0.0 -1 1 {} H 0.0 {0.635957 0.442603 0.396659} H41 6368 0.0 -1 1 {} H 0.0 {0.65077 0.437488 0.400565} H42 6369 0.0 -1 14 {} Si 0.0 {0.365961 0.274592 0.6578} Si6 6370 0.0 -1 8 {} O 0.0 {0.366752 0.279174 0.673049} O6 6371 0.0 -1 14 {} Si 0.0 {0.362903 0.274609 0.687779} Si7 6372 0.0 -1 8 {} O 0.0 {0.369003 0.290869 0.70526} O7 6373 0.0 -1 14 {} Si 0.0 {0.286448 0.60041 0.603351} Si8 6374 0.0 -1 7 {} N 0.0 {0.283565 0.584767 0.604622} N2 6375 0.0 -1 14 {} Si 0.0 {0.289169 0.574869 0.593123} Si9 6376 0.0 -1 14 {} Si 0.0 {0.38142 0.287727 0.696751} Si10 6377 0.0 -1 6 {} C 0.0 {0.351689 0.277116 0.647383} C3 6378 0.0 -1 7 {} N 0.0 {0.345518 0.273479 0.696746} N 6379 0.0 -1 8 {} O 0.0 {0.375745 0.265124 0.688035} O8 6380 0.0 -1 8 {} O 0.0 {0.372076 0.259396 0.66026} O9 6381 0.0 -1 8 {} O 0.0 {0.385721 0.283314 0.65293} O10 6382 0.0 -1 1 {} H 0.0 {0.276891 0.606633 0.596697} H18 6383 0.0 -1 1 {} H 0.0 {0.302231 0.604192 0.597809} H19 6384 0.0 -1 1 {} H 0.0 {0.284899 0.581013 0.578935} H20 6385 0.0 -1 1 {} H 0.0 {0.302335 0.575663 0.591678} H22 6386 0.0 -1 1 {} H 0.0 {0.370854 0.288548 0.714628} H24 6387 0.0 -1 1 {} H 0.0 {0.38257 0.297268 0.684702} H25 6388 0.0 -1 1 {} H 0.0 {0.350097 0.268382 0.641396} H26 6389 0.0 -1 1 {} H 0.0 {0.352741 0.286059 0.641575} H27 6390 0.0 -1 1 {} H 0.0 {0.333103 0.27221 0.671003} H28 6391 0.0 -1 1 {} H 0.0 {0.346463 0.279334 0.704761} H29 6392 0.0 -1 1 {} H 0.0 {0.340465 0.279484 0.690486} H31 6393 0.0 -1 1 {} H 0.0 {0.382134 0.270023 0.693641} H32 6394 0.0 -1 1 {} H 0.0 {0.374914 0.259149 0.670134} H33 6395 0.0 -1 1 {} H 0.0 {0.389983 0.274357 0.650747} H34 6396 0.0 -1 7 {} N 0.0 {0.282331 0.559515 0.594618} N3 6397 0.0 -1 1 {} H 0.0 {0.281374 0.557645 0.584599} H16 6398 0.0 -1 1 {} H 0.0 {0.28999 0.552271 0.598286} H17 6399 0.0 -1 7 {} N 0.0 {0.398945 0.28243 0.705727} N6 6400 0.0 -1 1 {} H 0.0 {0.65984 0.638108 0.434149} H41 6401 0.0 -1 1 {} H 0.0 {0.397762 0.275798 0.713687} H42 6402 0.0 -1 14 {} Si 0.0 {0.555452 0.207989 0.366267} Si6 6403 0.0 -1 8 {} O 0.0 {0.540319 0.209252 0.369817} O6 6404 0.0 -1 14 {} Si 0.0 {0.526016 0.209614 0.364758} Si7 6405 0.0 -1 8 {} O 0.0 {0.52924 0.22184 0.355117} O7 6406 0.0 -1 14 {} Si 0.0 {0.520861 0.235294 0.352897} Si8 6407 0.0 -1 7 {} N 0.0 {0.50595 0.243079 0.356024} N2 6408 0.0 -1 14 {} Si 0.0 {0.494791 0.236959 0.366537} Si9 6409 0.0 -1 14 {} Si 0.0 {0.498911 0.256574 0.348844} Si10 6410 0.0 -1 6 {} C 0.0 {0.562907 0.203911 0.349126} C3 6411 0.0 -1 7 {} N 0.0 {0.509975 0.199054 0.358451} N 6412 0.0 -1 8 {} O 0.0 {0.531285 0.239238 0.387621} O8 6413 0.0 -1 8 {} O 0.0 {0.563291 0.201961 0.385203} O9 6414 0.0 -1 8 {} O 0.0 {0.775153 0.498549 0.419483} O10 6415 0.0 -1 1 {} H 0.0 {0.526025 0.225222 0.407295} H18 6416 0.0 -1 1 {} H 0.0 {0.555157 0.236573 0.34046} H19 6417 0.0 -1 1 {} H 0.0 {0.506293 0.23054 0.377464} H20 6418 0.0 -1 1 {} H 0.0 {0.483972 0.244004 0.376431} H22 6419 0.0 -1 1 {} H 0.0 {0.48383 0.259666 0.341678} H24 6420 0.0 -1 1 {} H 0.0 {0.503033 0.245535 0.334179} H25 6421 0.0 -1 1 {} H 0.0 {0.559918 0.194512 0.344716} H26 6422 0.0 -1 1 {} H 0.0 {0.57337 0.204189 0.350475} H27 6423 0.0 -1 1 {} H 0.0 {0.559469 0.211075 0.342262} H28 6424 0.0 -1 1 {} H 0.0 {0.505523 0.194922 0.366679} H29 6425 0.0 -1 1 {} H 0.0 {0.513912 0.190843 0.353818} H31 6426 0.0 -1 1 {} H 0.0 {0.535567 0.247269 0.392141} H32 6427 0.0 -1 1 {} H 0.0 {0.554647 0.202325 0.390201} H33 6428 0.0 -1 1 {} H 0.0 {0.766491 0.494381 0.416058} H34 6429 0.0 -1 7 {} N 0.0 {0.485924 0.219121 0.359521} N3 6430 0.0 -1 1 {} H 0.0 {0.476508 0.222436 0.356402} H16 6431 0.0 -1 1 {} H 0.0 {0.484406 0.214454 0.36864} H17 6432 0.0 -1 7 {} N 0.0 {0.509996 0.272913 0.350954} N6 6433 0.0 -1 1 {} H 0.0 {0.506701 0.277809 0.343226} H41 6434 0.0 -1 1 {} H 0.0 {0.519611 0.269571 0.348017} H42 6435 0.0 -1 14 {} Si 0.0 {0.401908 0.603939 0.649286} Si6 6436 0.0 -1 8 {} O 0.0 {0.409716 0.59051 0.652298} O6 6437 0.0 -1 14 {} Si 0.0 {0.414759 0.577088 0.646367} Si7 6438 0.0 -1 8 {} O 0.0 {0.430593 0.581121 0.647444} O7 6439 0.0 -1 14 {} Si 0.0 {0.445155 0.580727 0.64174} Si8 6440 0.0 -1 7 {} N 0.0 {0.453369 0.589858 0.626828} N2 6441 0.0 -1 14 {} Si 0.0 {0.437587 0.582554 0.616741} Si9 6442 0.0 -1 14 {} Si 0.0 {0.461978 0.588402 0.612483} Si10 6443 0.0 -1 6 {} C 0.0 {0.411808 0.619681 0.652772} C3 6444 0.0 -1 7 {} N 0.0 {0.410666 0.559771 0.65661} N 6445 0.0 -1 8 {} O 0.0 {0.412321 0.578634 0.631443} O8 6446 0.0 -1 8 {} O 0.0 {0.386041 0.597173 0.660798} O9 6447 0.0 -1 8 {} O 0.0 {0.396054 0.602332 0.633927} O10 6448 0.0 -1 1 {} H 0.0 {0.452085 0.589458 0.654347} H18 6449 0.0 -1 1 {} H 0.0 {0.452387 0.567937 0.644384} H19 6450 0.0 -1 1 {} H 0.0 {0.448084 0.552446 0.630417} H20 6451 0.0 -1 1 {} H 0.0 {0.421778 0.580077 0.626232} H22 6452 0.0 -1 1 {} H 0.0 {0.455543 0.591385 0.599998} H24 6453 0.0 -1 1 {} H 0.0 {0.463443 0.571837 0.612544} H25 6454 0.0 -1 1 {} H 0.0 {0.411605 0.621428 0.662785} H26 6455 0.0 -1 1 {} H 0.0 {0.406325 0.628007 0.647397} H27 6456 0.0 -1 1 {} H 0.0 {0.421784 0.618014 0.65038} H28 6457 0.0 -1 1 {} H 0.0 {0.401786 0.558298 0.651026} H29 6458 0.0 -1 1 {} H 0.0 {0.41996 0.555864 0.655754} H31 6459 0.0 -1 1 {} H 0.0 {0.451953 0.624637 0.58565} H32 6460 0.0 -1 1 {} H 0.0 {0.386125 0.587817 0.65789} H33 6461 0.0 -1 1 {} H 0.0 {0.398934 0.593144 0.630988} H34 6462 0.0 -1 7 {} N 0.0 {0.425812 0.598194 0.607654} N3 6463 0.0 -1 1 {} H 0.0 {0.418079 0.593477 0.602387} H16 6464 0.0 -1 1 {} H 0.0 {0.43248 0.601756 0.600105} H17 6465 0.0 -1 7 {} N 0.0 {0.478773 0.598505 0.615006} N6 6466 0.0 -1 1 {} H 0.0 {0.48599 0.600174 0.608028} H41 6467 0.0 -1 1 {} H 0.0 {0.474695 0.607436 0.615801} H42 6468 0.0 -1 14 {} Si 0.0 {0.553793 0.626573 0.462311} Si6 6469 0.0 -1 8 {} O 0.0 {0.568587 0.630313 0.466522} O6 6470 0.0 -1 14 {} Si 0.0 {0.583203 0.62744 0.462572} Si7 6471 0.0 -1 8 {} O 0.0 {0.584192 0.611238 0.463645} O7 6472 0.0 -1 14 {} Si 0.0 {0.593881 0.599166 0.462446} Si8 6473 0.0 -1 7 {} N 0.0 {0.611471 0.595178 0.470894} N2 6474 0.0 -1 14 {} Si 0.0 {0.625715 0.587831 0.467289} Si9 6475 0.0 -1 14 {} Si 0.0 {0.614267 0.609822 0.478207} Si10 6476 0.0 -1 6 {} C 0.0 {0.636285 0.578861 0.480523} C3 6477 0.0 -1 7 {} N 0.0 {0.595009 0.638347 0.454535} N 6478 0.0 -1 8 {} O 0.0 {0.592788 0.627902 0.481614} O8 6479 0.0 -1 8 {} O 0.0 {0.576843 0.563957 0.433443} O9 6480 0.0 -1 8 {} O 0.0 {0.551279 0.612118 0.468987} O10 6481 0.0 -1 1 {} H 0.0 {0.586994 0.587487 0.467749} H18 6482 0.0 -1 1 {} H 0.0 {0.596302 0.597211 0.446562} H19 6483 0.0 -1 1 {} H 0.0 {0.731671 0.565072 0.435934} H20 6484 0.0 -1 1 {} H 0.0 {0.426614 0.635922 0.307447} H22 6485 0.0 -1 1 {} H 0.0 {0.623713 0.608046 0.491867} H24 6486 0.0 -1 1 {} H 0.0 {0.601458 0.619754 0.481731} H25 6487 0.0 -1 1 {} H 0.0 {0.637042 0.585543 0.489265} H26 6488 0.0 -1 1 {} H 0.0 {0.645557 0.576189 0.476369} H27 6489 0.0 -1 1 {} H 0.0 {0.630808 0.570417 0.482836} H28 6490 0.0 -1 1 {} H 0.0 {0.591386 0.641641 0.445721} H29 6491 0.0 -1 1 {} H 0.0 {0.604428 0.635238 0.453737} H31 6492 0.0 -1 1 {} H 0.0 {0.586172 0.623126 0.486848} H32 6493 0.0 -1 1 {} H 0.0 {0.552944 0.623979 0.447856} H33 6494 0.0 -1 1 {} H 0.0 {0.560531 0.607094 0.468074} H34 6495 0.0 -1 7 {} N 0.0 {0.620683 0.569276 0.456986} N3 6496 0.0 -1 1 {} H 0.0 {0.610814 0.569766 0.460562} H16 6497 0.0 -1 1 {} H 0.0 {0.620577 0.5737 0.447387} H17 6498 0.0 -1 7 {} N 0.0 {0.622356 0.622979 0.465951} N6 6499 0.0 -1 1 {} H 0.0 {0.619022 0.61925 0.456968} H41 6500 0.0 -1 1 {} H 0.0 {0.616944 0.630728 0.469054} H42 6501 0.0 -1 14 {} Si 0.0 {0.520848 0.515918 0.64035} Si6 6502 0.0 -1 8 {} O 0.0 {0.529967 0.528563 0.641118} O6 6503 0.0 -1 14 {} Si 0.0 {0.540149 0.536868 0.631982} Si7 6504 0.0 -1 8 {} O 0.0 {0.531005 0.541225 0.619685} O7 6505 0.0 -1 14 {} Si 0.0 {0.517263 0.540308 0.613122} Si8 6506 0.0 -1 7 {} N 0.0 {0.504459 0.553461 0.603715} N2 6507 0.0 -1 14 {} Si 0.0 {0.51588 0.566023 0.614256} Si9 6508 0.0 -1 14 {} Si 0.0 {0.491498 0.568023 0.604655} Si10 6509 0.0 -1 6 {} C 0.0 {0.523517 0.501675 0.628947} C3 6510 0.0 -1 7 {} N 0.0 {0.545353 0.555111 0.642665} N 6511 0.0 -1 8 {} O 0.0 {0.550384 0.525435 0.627171} O8 6512 0.0 -1 8 {} O 0.0 {0.50435 0.528716 0.636062} O9 6513 0.0 -1 8 {} O 0.0 {0.522348 0.515012 0.656395} O10 6514 0.0 -1 1 {} H 0.0 {0.519207 0.528095 0.605421} H18 6515 0.0 -1 1 {} H 0.0 {0.508137 0.53545 0.62699} H19 6516 0.0 -1 1 {} H 0.0 {0.510848 0.568144 0.628471} H20 6517 0.0 -1 1 {} H 0.0 {0.530554 0.560739 0.615843} H22 6518 0.0 -1 1 {} H 0.0 {0.495446 0.577397 0.613391} H24 6519 0.0 -1 1 {} H 0.0 {0.47806 0.561752 0.610664} H25 6520 0.0 -1 1 {} H 0.0 {0.528022 0.493729 0.634637} H26 6521 0.0 -1 1 {} H 0.0 {0.530557 0.502538 0.621081} H27 6522 0.0 -1 1 {} H 0.0 {0.514421 0.499631 0.624364} H28 6523 0.0 -1 1 {} H 0.0 {0.554971 0.553539 0.646003} H29 6524 0.0 -1 1 {} H 0.0 {0.537983 0.559736 0.648382} H31 6525 0.0 -1 1 {} H 0.0 {0.558398 0.531241 0.623566} H32 6526 0.0 -1 1 {} H 0.0 {0.505577 0.534845 0.643508} H33 6527 0.0 -1 1 {} H 0.0 {0.515178 0.519984 0.660808} H34 6528 0.0 -1 7 {} N 0.0 {0.520751 0.582693 0.603846} N3 6529 0.0 -1 1 {} H 0.0 {0.520215 0.59028 0.610746} H16 6530 0.0 -1 1 {} H 0.0 {0.531394 0.581332 0.602568} H17 6531 0.0 -1 7 {} N 0.0 {0.487033 0.576297 0.589637} N6 6532 0.0 -1 1 {} H 0.0 {0.489671 0.569894 0.58139} H41 6533 0.0 -1 1 {} H 0.0 {0.493534 0.583615 0.58747} H42 6534 0.0 -1 14 {} Si 0.0 {0.293641 0.540043 0.370159} Si6 6535 0.0 -1 8 {} O 0.0 {0.297912 0.555747 0.371319} O6 6536 0.0 -1 14 {} Si 0.0 {0.304821 0.569857 0.367565} Si7 6537 0.0 -1 8 {} O 0.0 {0.294176 0.579467 0.374446} O7 6538 0.0 -1 14 {} Si 0.0 {0.281785 0.589802 0.373291} Si8 6539 0.0 -1 7 {} N 0.0 {0.417024 0.22944 0.506446} N2 6540 0.0 -1 14 {} Si 0.0 {0.411658 0.244824 0.509579} Si9 6541 0.0 -1 14 {} Si 0.0 {0.404149 0.220557 0.51146} Si10 6542 0.0 -1 6 {} C 0.0 {0.292106 0.526682 0.383339} C3 6543 0.0 -1 7 {} N 0.0 {0.323854 0.569699 0.368744} N 6544 0.0 -1 8 {} O 0.0 {0.300362 0.568725 0.352071} O8 6545 0.0 -1 8 {} O 0.0 {0.286634 0.476539 0.373785} O9 6546 0.0 -1 8 {} O 0.0 {0.288936 0.540709 0.350663} O10 6547 0.0 -1 1 {} H 0.0 {0.269516 0.583114 0.38484} H18 6548 0.0 -1 1 {} H 0.0 {0.285526 0.602018 0.383275} H19 6549 0.0 -1 1 {} H 0.0 {0.395695 0.247809 0.514266} H20 6550 0.0 -1 1 {} H 0.0 {0.419127 0.248397 0.524148} H22 6551 0.0 -1 1 {} H 0.0 {0.392644 0.230873 0.516828} H24 6552 0.0 -1 1 {} H 0.0 {0.41028 0.209822 0.523965} H25 6553 0.0 -1 1 {} H 0.0 {0.283659 0.528176 0.389805} H26 6554 0.0 -1 1 {} H 0.0 {0.619073 0.677371 0.413152} H27 6555 0.0 -1 1 {} H 0.0 {0.291794 0.517331 0.377702} H28 6556 0.0 -1 1 {} H 0.0 {0.328151 0.563783 0.361817} H29 6557 0.0 -1 1 {} H 0.0 {0.326038 0.564849 0.377109} H31 6558 0.0 -1 1 {} H 0.0 {0.292593 0.594806 0.348168} H32 6559 0.0 -1 1 {} H 0.0 {0.289363 0.467374 0.376214} H33 6560 0.0 -1 1 {} H 0.0 {0.614164 0.65625 0.451885} H34 6561 0.0 -1 7 {} N 0.0 {0.415514 0.255775 0.49448} N3 6562 0.0 -1 1 {} H 0.0 {0.424393 0.252263 0.491995} H16 6563 0.0 -1 1 {} H 0.0 {0.409441 0.251386 0.487853} H17 6564 0.0 -1 7 {} N 0.0 {0.400091 0.207225 0.497449} N6 6565 0.0 -1 1 {} H 0.0 {0.347139 0.637124 0.442616} H41 6566 0.0 -1 1 {} H 0.0 {0.40901 0.204051 0.495109} H42 6567 0.0 -1 14 {} Si 0.0 {0.365544 0.219556 0.547607} Si6 6568 0.0 -1 8 {} O 0.0 {0.373896 0.228584 0.557196} O6 6569 0.0 -1 14 {} Si 0.0 {0.387737 0.230564 0.563409} Si7 6570 0.0 -1 8 {} O 0.0 {0.602474 0.426712 0.777969} O7 6571 0.0 -1 14 {} Si 0.0 {0.605323 0.414188 0.768995} Si8 6572 0.0 -1 7 {} N 0.0 {0.598484 0.407254 0.755936} N2 6573 0.0 -1 14 {} Si 0.0 {0.582117 0.410685 0.759101} Si9 6574 0.0 -1 14 {} Si 0.0 {0.599037 0.395591 0.744018} Si10 6575 0.0 -1 6 {} C 0.0 {0.363232 0.225319 0.530051} C3 6576 0.0 -1 7 {} N 0.0 {0.393588 0.219786 0.575222} N 6577 0.0 -1 8 {} O 0.0 {0.626429 0.395144 0.741643} O8 6578 0.0 -1 8 {} O 0.0 {0.355667 0.215171 0.559358} O9 6579 0.0 -1 8 {} O 0.0 {0.378641 0.202834 0.550573} O10 6580 0.0 -1 1 {} H 0.0 {0.608649 0.400848 0.77779} H18 6581 0.0 -1 1 {} H 0.0 {0.645951 0.410307 0.783939} H19 6582 0.0 -1 1 {} H 0.0 {0.57635 0.417981 0.774633} H20 6583 0.0 -1 1 {} H 0.0 {0.577403 0.420237 0.745696} H22 6584 0.0 -1 1 {} H 0.0 {0.597441 0.380983 0.750654} H24 6585 0.0 -1 1 {} H 0.0 {0.61553 0.397122 0.742645} H25 6586 0.0 -1 1 {} H 0.0 {0.370865 0.23286 0.530207} H26 6587 0.0 -1 1 {} H 0.0 {0.352838 0.227893 0.527713} H27 6588 0.0 -1 1 {} H 0.0 {0.368622 0.217852 0.523734} H28 6589 0.0 -1 1 {} H 0.0 {0.394131 0.221726 0.585442} H29 6590 0.0 -1 1 {} H 0.0 {0.402855 0.215846 0.57253} H31 6591 0.0 -1 1 {} H 0.0 {0.625434 0.382501 0.74298} H32 6592 0.0 -1 1 {} H 0.0 {0.318257 0.259888 0.540558} H33 6593 0.0 -1 1 {} H 0.0 {0.373166 0.196408 0.55516} H34 6594 0.0 -1 7 {} N 0.0 {0.573347 0.395609 0.767733} N3 6595 0.0 -1 1 {} H 0.0 {0.580475 0.391228 0.773761} H16 6596 0.0 -1 1 {} H 0.0 {0.571234 0.388901 0.760783} H17 6597 0.0 -1 7 {} N 0.0 {0.59383 0.396121 0.725215} N6 6598 0.0 -1 1 {} H 0.0 {0.588923 0.404801 0.723733} H41 6599 0.0 -1 1 {} H 0.0 {0.602796 0.398172 0.721262} H42 6600 0.0 -1 14 {} Si 0.0 {0.751885 0.511773 0.449062} Si6 6601 0.0 -1 8 {} O 0.0 {0.683618 0.496148 0.473923} O6 6602 0.0 -1 14 {} Si 0.0 {0.694996 0.494081 0.462737} Si7 6603 0.0 -1 8 {} O 0.0 {0.707791 0.499484 0.470019} O7 6604 0.0 -1 14 {} Si 0.0 {0.71734 0.512133 0.472118} Si8 6605 0.0 -1 7 {} N 0.0 {0.712777 0.527728 0.475799} N2 6606 0.0 -1 14 {} Si 0.0 {0.697698 0.531768 0.468877} Si9 6607 0.0 -1 14 {} Si 0.0 {0.717269 0.539572 0.485963} Si10 6608 0.0 -1 6 {} C 0.0 {0.762762 0.516112 0.46353} C3 6609 0.0 -1 7 {} N 0.0 {0.692127 0.477692 0.45312} N 6610 0.0 -1 8 {} O 0.0 {0.69143 0.506697 0.452619} O8 6611 0.0 -1 8 {} O 0.0 {0.737032 0.516196 0.447288} O9 6612 0.0 -1 8 {} O 0.0 {0.756175 0.50833 0.434597} O10 6613 0.0 -1 1 {} H 0.0 {0.727441 0.509673 0.487331} H18 6614 0.0 -1 1 {} H 0.0 {0.727267 0.512252 0.459768} H19 6615 0.0 -1 1 {} H 0.0 {0.693468 0.516964 0.458587} H20 6616 0.0 -1 1 {} H 0.0 {0.685023 0.532103 0.477508} H22 6617 0.0 -1 1 {} H 0.0 {0.712489 0.533147 0.50012} H24 6618 0.0 -1 1 {} H 0.0 {0.71322 0.555421 0.486924} H25 6619 0.0 -1 1 {} H 0.0 {0.768558 0.507692 0.466007} H26 6620 0.0 -1 1 {} H 0.0 {0.767037 0.525245 0.460969} H27 6621 0.0 -1 1 {} H 0.0 {0.74879 0.497044 0.396848} H28 6622 0.0 -1 1 {} H 0.0 {0.686621 0.471969 0.46011} H29 6623 0.0 -1 1 {} H 0.0 {0.701345 0.473006 0.45263} H31 6624 0.0 -1 1 {} H 0.0 {0.680779 0.510602 0.443407} H32 6625 0.0 -1 1 {} H 0.0 {0.732453 0.51272 0.438949} H33 6626 0.0 -1 1 {} H 0.0 {0.747813 0.502958 0.42904} H34 6627 0.0 -1 7 {} N 0.0 {0.701624 0.547128 0.456588} N3 6628 0.0 -1 1 {} H 0.0 {0.712447 0.545628 0.458371} H16 6629 0.0 -1 1 {} H 0.0 {0.700667 0.543029 0.446973} H17 6630 0.0 -1 7 {} N 0.0 {0.73623 0.541183 0.486431} N6 6631 0.0 -1 1 {} H 0.0 {0.740242 0.53742 0.477761} H41 6632 0.0 -1 1 {} H 0.0 {0.739254 0.53459 0.493468} H42 6633 0.0 -1 14 {} Si 0.0 {0.429738 0.40314 0.693956} Si6 6634 0.0 -1 8 {} O 0.0 {0.436421 0.416865 0.697056} O6 6635 0.0 -1 14 {} Si 0.0 {0.442562 0.426747 0.707791} Si7 6636 0.0 -1 8 {} O 0.0 {0.442527 0.439634 0.698177} O7 6637 0.0 -1 14 {} Si 0.0 {0.444137 0.44882 0.685889} Si8 6638 0.0 -1 7 {} N 0.0 {0.461938 0.4541 0.681247} N2 6639 0.0 -1 14 {} Si 0.0 {0.47786 0.454707 0.683032} Si9 6640 0.0 -1 14 {} Si 0.0 {0.461044 0.434993 0.677732} Si10 6641 0.0 -1 6 {} C 0.0 {0.435029 0.392542 0.678893} C3 6642 0.0 -1 7 {} N 0.0 {0.437041 0.430593 0.726416} N 6643 0.0 -1 8 {} O 0.0 {0.459059 0.423268 0.70688} O8 6644 0.0 -1 8 {} O 0.0 {0.414541 0.407372 0.696274} O9 6645 0.0 -1 8 {} O 0.0 {0.431082 0.394719 0.711918} O10 6646 0.0 -1 1 {} H 0.0 {0.428395 0.456659 0.685703} H18 6647 0.0 -1 1 {} H 0.0 {0.498183 0.449617 0.653953} H19 6648 0.0 -1 1 {} H 0.0 {0.482841 0.445728 0.696483} H20 6649 0.0 -1 1 {} H 0.0 {0.487158 0.449649 0.669702} H22 6650 0.0 -1 1 {} H 0.0 {0.445628 0.439397 0.672382} H24 6651 0.0 -1 1 {} H 0.0 {0.459538 0.427988 0.691357} H25 6652 0.0 -1 1 {} H 0.0 {0.43613 0.399992 0.67217} H26 6653 0.0 -1 1 {} H 0.0 {0.427069 0.386561 0.675907} H27 6654 0.0 -1 1 {} H 0.0 {0.44387 0.38754 0.680765} H28 6655 0.0 -1 1 {} H 0.0 {0.43105 0.421692 0.727926} H29 6656 0.0 -1 1 {} H 0.0 {0.429767 0.437233 0.726205} H31 6657 0.0 -1 1 {} H 0.0 {0.463361 0.430777 0.711982} H32 6658 0.0 -1 1 {} H 0.0 {0.412583 0.414663 0.689819} H33 6659 0.0 -1 1 {} H 0.0 {0.421725 0.392126 0.714084} H34 6660 0.0 -1 7 {} N 0.0 {0.483629 0.473185 0.686704} N3 6661 0.0 -1 1 {} H 0.0 {0.474372 0.476067 0.68894} H16 6662 0.0 -1 1 {} H 0.0 {0.487343 0.475132 0.67754} H17 6663 0.0 -1 7 {} N 0.0 {0.46923 0.424762 0.661861} N6 6664 0.0 -1 1 {} H 0.0 {0.475472 0.418239 0.666913} H41 6665 0.0 -1 1 {} H 0.0 {0.474855 0.430757 0.655639} H42 6666 0.0 -1 14 {} Si 0.0 {0.363235 0.335115 0.435311} Si6 6667 0.0 -1 8 {} O 0.0 {0.363891 0.335522 0.450797} O6 6668 0.0 -1 14 {} Si 0.0 {0.367391 0.3278 0.463865} Si7 6669 0.0 -1 8 {} O 0.0 {0.354152 0.319184 0.464386} O7 6670 0.0 -1 14 {} Si 0.0 {0.343273 0.31 0.457969} Si8 6671 0.0 -1 7 {} N 0.0 {0.346749 0.29509 0.44515} N2 6672 0.0 -1 14 {} Si 0.0 {0.361836 0.291115 0.45858} Si9 6673 0.0 -1 14 {} Si 0.0 {0.358752 0.281839 0.436836} Si10 6674 0.0 -1 6 {} C 0.0 {0.369371 0.321282 0.424544} C3 6675 0.0 -1 7 {} N 0.0 {0.381371 0.316693 0.468098} N 6676 0.0 -1 8 {} O 0.0 {0.360493 0.344351 0.473714} O8 6677 0.0 -1 8 {} O 0.0 {0.369728 0.349653 0.432309} O9 6678 0.0 -1 8 {} O 0.0 {0.342571 0.339279 0.43465} O10 6679 0.0 -1 1 {} H 0.0 {0.334844 0.305614 0.469147} H18 6680 0.0 -1 1 {} H 0.0 {0.331167 0.320042 0.449307} H19 6681 0.0 -1 1 {} H 0.0 {0.326749 0.369552 0.447011} H20 6682 0.0 -1 1 {} H 0.0 {0.374085 0.29628 0.457821} H22 6683 0.0 -1 1 {} H 0.0 {0.364868 0.277183 0.451038} H24 6684 0.0 -1 1 {} H 0.0 {0.373816 0.286027 0.430297} H25 6685 0.0 -1 1 {} H 0.0 {0.377065 0.323515 0.417539} H26 6686 0.0 -1 1 {} H 0.0 {0.36053 0.318926 0.419065} H27 6687 0.0 -1 1 {} H 0.0 {0.371347 0.31353 0.431365} H28 6688 0.0 -1 1 {} H 0.0 {0.380379 0.312184 0.477251} H29 6689 0.0 -1 1 {} H 0.0 {0.389583 0.322598 0.467502} H31 6690 0.0 -1 1 {} H 0.0 {0.356311 0.350173 0.466875} H32 6691 0.0 -1 1 {} H 0.0 {0.363879 0.354574 0.426793} H33 6692 0.0 -1 1 {} H 0.0 {0.33986 0.340599 0.443745} H34 6693 0.0 -1 7 {} N 0.0 {0.355582 0.286064 0.477005} N3 6694 0.0 -1 1 {} H 0.0 {0.363982 0.286722 0.483219} H16 6695 0.0 -1 1 {} H 0.0 {0.351224 0.295901 0.478507} H17 6696 0.0 -1 7 {} N 0.0 {0.35434 0.266047 0.432625} N6 6697 0.0 -1 1 {} H 0.0 {0.354175 0.266887 0.421696} H41 6698 0.0 -1 1 {} H 0.0 {0.34457 0.264438 0.435452} H42 6699 0.0 -1 14 {} Si 0.0 {0.325203 0.364516 0.663671} Si6 6700 0.0 -1 8 {} O 0.0 {0.315621 0.358948 0.652351} O6 6701 0.0 -1 14 {} Si 0.0 {0.628368 0.300092 0.402073} Si7 6702 0.0 -1 8 {} O 0.0 {0.620189 0.286941 0.403762} O7 6703 0.0 -1 14 {} Si 0.0 {0.606164 0.284664 0.379092} Si8 6704 0.0 -1 7 {} N 0.0 {0.589945 0.285961 0.383005} N2 6705 0.0 -1 14 {} Si 0.0 {0.584617 0.291149 0.368594} Si9 6706 0.0 -1 14 {} Si 0.0 {0.573153 0.281109 0.391132} Si10 6707 0.0 -1 6 {} C 0.0 {0.315282 0.367145 0.679596} C3 6708 0.0 -1 7 {} N 0.0 {0.632757 0.310924 0.412726} N 6709 0.0 -1 8 {} O 0.0 {0.620825 0.309241 0.385316} O8 6710 0.0 -1 8 {} O 0.0 {0.331068 0.380236 0.656308} O9 6711 0.0 -1 8 {} O 0.0 {0.337767 0.355164 0.660595} O10 6712 0.0 -1 1 {} H 0.0 {0.613824 0.300165 0.381598} H18 6713 0.0 -1 1 {} H 0.0 {0.615464 0.285584 0.394357} H19 6714 0.0 -1 1 {} H 0.0 {0.582369 0.28025 0.357859} H20 6715 0.0 -1 1 {} H 0.0 {0.568207 0.298986 0.368606} H22 6716 0.0 -1 1 {} H 0.0 {0.559517 0.284542 0.386741} H24 6717 0.0 -1 1 {} H 0.0 {0.575109 0.28997 0.402354} H25 6718 0.0 -1 1 {} H 0.0 {0.313693 0.358698 0.684916} H26 6719 0.0 -1 1 {} H 0.0 {0.306156 0.371003 0.67627} H27 6720 0.0 -1 1 {} H 0.0 {0.32067 0.373712 0.686092} H28 6721 0.0 -1 1 {} H 0.0 {0.638631 0.30787 0.420819} H29 6722 0.0 -1 1 {} H 0.0 {0.316714 0.324339 0.66486} H31 6723 0.0 -1 1 {} H 0.0 {0.609644 0.485127 0.804346} H32 6724 0.0 -1 1 {} H 0.0 {0.338932 0.383737 0.662415} H33 6725 0.0 -1 1 {} H 0.0 {0.341018 0.351815 0.669705} H34 6726 0.0 -1 7 {} N 0.0 {0.589882 0.308618 0.361803} N3 6727 0.0 -1 1 {} H 0.0 {0.598627 0.306491 0.356242} H16 6728 0.0 -1 1 {} H 0.0 {0.593412 0.311897 0.370757} H17 6729 0.0 -1 7 {} N 0.0 {0.574002 0.263107 0.398186} N6 6730 0.0 -1 1 {} H 0.0 {0.563858 0.262902 0.399587} H41 6731 0.0 -1 1 {} H 0.0 {0.577149 0.264286 0.407843} H42 6732 0.0 -1 14 {} Si 0.0 {0.24244 0.392527 0.52081} Si6 6733 0.0 -1 8 {} O 0.0 {0.258373 0.389219 0.534896} O6 6734 0.0 -1 14 {} Si 0.0 {0.264043 0.374349 0.534631} Si7 6735 0.0 -1 8 {} O 0.0 {0.278369 0.380055 0.537833} O7 6736 0.0 -1 14 {} Si 0.0 {0.289312 0.390279 0.532228} Si8 6737 0.0 -1 7 {} N 0.0 {0.308508 0.38916 0.537208} N2 6738 0.0 -1 14 {} Si 0.0 {0.323837 0.388212 0.530681} Si9 6739 0.0 -1 14 {} Si 0.0 {0.30551 0.383691 0.552333} Si10 6740 0.0 -1 6 {} C 0.0 {0.226132 0.389358 0.522632} C3 6741 0.0 -1 7 {} N 0.0 {0.260166 0.361038 0.5449} N 6742 0.0 -1 8 {} O 0.0 {0.266105 0.369993 0.51334} O8 6743 0.0 -1 8 {} O 0.0 {0.250229 0.392589 0.506984} O9 6744 0.0 -1 8 {} O 0.0 {0.280741 0.400252 0.559245} O10 6745 0.0 -1 1 {} H 0.0 {0.293454 0.386138 0.516076} H18 6746 0.0 -1 1 {} H 0.0 {0.284743 0.404026 0.536009} H19 6747 0.0 -1 1 {} H 0.0 {0.335031 0.38938 0.540273} H20 6748 0.0 -1 1 {} H 0.0 {0.324251 0.376213 0.520169} H22 6749 0.0 -1 1 {} H 0.0 {0.307268 0.366515 0.552341} H24 6750 0.0 -1 1 {} H 0.0 {0.291362 0.392915 0.558012} H25 6751 0.0 -1 1 {} H 0.0 {0.221291 0.386864 0.514154} H26 6752 0.0 -1 1 {} H 0.0 {0.225395 0.382483 0.530571} H27 6753 0.0 -1 1 {} H 0.0 {0.208437 0.355666 0.584917} H28 6754 0.0 -1 1 {} H 0.0 {0.259294 0.351535 0.540612} H29 6755 0.0 -1 1 {} H 0.0 {0.264802 0.359922 0.553285} H31 6756 0.0 -1 1 {} H 0.0 {0.259663 0.376742 0.509772} H32 6757 0.0 -1 1 {} H 0.0 {0.247083 0.400135 0.501634} H33 6758 0.0 -1 1 {} H 0.0 {0.277127 0.395963 0.567436} H34 6759 0.0 -1 7 {} N 0.0 {0.325903 0.402815 0.516877} N3 6760 0.0 -1 1 {} H 0.0 {0.33215 0.409869 0.520822} H16 6761 0.0 -1 1 {} H 0.0 {0.316224 0.405836 0.517874} H17 6762 0.0 -1 7 {} N 0.0 {0.317367 0.394123 0.563342} N6 6763 0.0 -1 1 {} H 0.0 {0.326476 0.38969 0.565779} H41 6764 0.0 -1 1 {} H 0.0 {0.319944 0.401875 0.557573} H42 6765 0.0 -1 14 {} Si 0.0 {0.480823 0.274896 0.357453} Si6 6766 0.0 -1 8 {} O 0.0 {0.473692 0.264574 0.366757} O6 6767 0.0 -1 14 {} Si 0.0 {0.463335 0.25403 0.372256} Si7 6768 0.0 -1 8 {} O 0.0 {0.774608 0.460392 0.538775} O7 6769 0.0 -1 14 {} Si 0.0 {0.77489 0.447668 0.528875} Si8 6770 0.0 -1 7 {} N 0.0 {0.76487 0.431889 0.533316} N2 6771 0.0 -1 14 {} Si 0.0 {0.75531 0.419447 0.528918} Si9 6772 0.0 -1 14 {} Si 0.0 {0.759402 0.439983 0.546481} Si10 6773 0.0 -1 6 {} C 0.0 {0.484487 0.291089 0.362369} C3 6774 0.0 -1 7 {} N 0.0 {0.454743 0.245421 0.359881} N 6775 0.0 -1 8 {} O 0.0 {0.472419 0.248623 0.38504} O8 6776 0.0 -1 8 {} O 0.0 {0.597999 0.253985 0.381171} O9 6777 0.0 -1 8 {} O 0.0 {0.472447 0.268599 0.341685} O10 6778 0.0 -1 1 {} H 0.0 {0.76675 0.44961 0.514979} H18 6779 0.0 -1 1 {} H 0.0 {0.789962 0.440505 0.528862} H19 6780 0.0 -1 1 {} H 0.0 {0.757106 0.407197 0.537934} H20 6781 0.0 -1 1 {} H 0.0 {0.739677 0.423187 0.531273} H22 6782 0.0 -1 1 {} H 0.0 {0.745673 0.446773 0.542733} H24 6783 0.0 -1 1 {} H 0.0 {0.768677 0.453631 0.549928} H25 6784 0.0 -1 1 {} H 0.0 {0.492365 0.291097 0.369394} H26 6785 0.0 -1 1 {} H 0.0 {0.456826 0.302471 0.361799} H27 6786 0.0 -1 1 {} H 0.0 {0.485559 0.297569 0.354288} H28 6787 0.0 -1 1 {} H 0.0 {0.457171 0.248342 0.350532} H29 6788 0.0 -1 1 {} H 0.0 {0.444686 0.247519 0.360941} H31 6789 0.0 -1 1 {} H 0.0 {0.477948 0.25636 0.389446} H32 6790 0.0 -1 1 {} H 0.0 {0.521636 0.220634 0.456628} H33 6791 0.0 -1 1 {} H 0.0 {0.466536 0.26184 0.345746} H34 6792 0.0 -1 7 {} N 0.0 {0.759724 0.417712 0.509007} N3 6793 0.0 -1 1 {} H 0.0 {0.770339 0.419109 0.509341} H16 6794 0.0 -1 1 {} H 0.0 {0.756296 0.427288 0.507003} H17 6795 0.0 -1 7 {} N 0.0 {0.76337 0.43111 0.563027} N6 6796 0.0 -1 1 {} H 0.0 {0.770761 0.43724 0.566264} H41 6797 0.0 -1 1 {} H 0.0 {0.768937 0.423741 0.558701} H42 6798 0.0 -1 14 {} Si 0.0 {0.479312 0.602776 0.383785} Si6 6799 0.0 -1 8 {} O 0.0 {0.486082 0.608118 0.369495} O6 6800 0.0 -1 14 {} Si 0.0 {0.499874 0.61269 0.362271} Si7 6801 0.0 -1 8 {} O 0.0 {0.508696 0.607166 0.375409} O7 6802 0.0 -1 14 {} Si 0.0 {0.507939 0.607033 0.391684} Si8 6803 0.0 -1 7 {} N 0.0 {0.507248 0.619814 0.402158} N2 6804 0.0 -1 14 {} Si 0.0 {0.51187 0.632206 0.392133} Si9 6805 0.0 -1 14 {} Si 0.0 {0.503068 0.624096 0.41739} Si10 6806 0.0 -1 6 {} C 0.0 {0.477061 0.585152 0.39034} C3 6807 0.0 -1 7 {} N 0.0 {0.501193 0.602208 0.346443} N 6808 0.0 -1 8 {} O 0.0 {0.501637 0.628373 0.363916} O8 6809 0.0 -1 8 {} O 0.0 {0.466273 0.576473 0.363169} O9 6810 0.0 -1 8 {} O 0.0 {0.478767 0.615182 0.392488} O10 6811 0.0 -1 1 {} H 0.0 {0.487174 0.61842 0.396152} H18 6812 0.0 -1 1 {} H 0.0 {0.50793 0.5907 0.397438} H19 6813 0.0 -1 1 {} H 0.0 {0.501913 0.645179 0.393437} H20 6814 0.0 -1 1 {} H 0.0 {0.732043 0.402448 0.53846} H22 6815 0.0 -1 1 {} H 0.0 {0.50499 0.64065 0.420729} H24 6816 0.0 -1 1 {} H 0.0 {0.51457 0.616191 0.424408} H25 6817 0.0 -1 1 {} H 0.0 {0.486861 0.58059 0.392788} H26 6818 0.0 -1 1 {} H 0.0 {0.472045 0.579804 0.382974} H27 6819 0.0 -1 1 {} H 0.0 {0.469642 0.583749 0.398541} H28 6820 0.0 -1 1 {} H 0.0 {0.492486 0.596521 0.346811} H29 6821 0.0 -1 1 {} H 0.0 {0.503648 0.600998 0.336638} H31 6822 0.0 -1 1 {} H 0.0 {0.505854 0.62899 0.374606} H32 6823 0.0 -1 1 {} H 0.0 {0.461327 0.584219 0.360564} H33 6824 0.0 -1 1 {} H 0.0 {0.563514 0.566984 0.399665} H34 6825 0.0 -1 7 {} N 0.0 {0.529792 0.636748 0.386075} N3 6826 0.0 -1 1 {} H 0.0 {0.526814 0.644748 0.379977} H16 6827 0.0 -1 1 {} H 0.0 {0.532329 0.629559 0.379315} H17 6828 0.0 -1 7 {} N 0.0 {0.483962 0.622138 0.420885} N6 6829 0.0 -1 1 {} H 0.0 {0.484341 0.612843 0.425655} H41 6830 0.0 -1 1 {} H 0.0 {0.480721 0.621833 0.411476} H42 6831 0.0 -1 14 {} Si 0.0 {0.468566 0.44332 0.461688} Si6 6832 0.0 -1 8 {} O 0.0 {0.468723 0.459034 0.461753} O6 6833 0.0 -1 14 {} Si 0.0 {0.508407 0.446709 0.435673} Si7 6834 0.0 -1 8 {} O 0.0 {0.505561 0.451805 0.450285} O7 6835 0.0 -1 14 {} Si 0.0 {0.503959 0.463627 0.46031} Si8 6836 0.0 -1 7 {} N 0.0 {0.517522 0.477416 0.45994} N2 6837 0.0 -1 14 {} Si 0.0 {0.533125 0.47429 0.454416} Si9 6838 0.0 -1 14 {} Si 0.0 {0.516041 0.493768 0.460383} Si10 6839 0.0 -1 6 {} C 0.0 {0.485785 0.428948 0.455753} C3 6840 0.0 -1 7 {} N 0.0 {0.508123 0.430606 0.429391} N 6841 0.0 -1 8 {} O 0.0 {0.526813 0.454876 0.433895} O8 6842 0.0 -1 8 {} O 0.0 {0.473957 0.478462 0.470778} O9 6843 0.0 -1 8 {} O 0.0 {0.473978 0.416934 0.460315} O10 6844 0.0 -1 1 {} H 0.0 {0.489377 0.469086 0.457252} H18 6845 0.0 -1 1 {} H 0.0 {0.502933 0.456378 0.473391} H19 6846 0.0 -1 1 {} H 0.0 {0.527844 0.462406 0.443396} H20 6847 0.0 -1 1 {} H 0.0 {0.542555 0.483695 0.447677} H22 6848 0.0 -1 1 {} H 0.0 {0.505265 0.496128 0.447543} H24 6849 0.0 -1 1 {} H 0.0 {0.52793 0.500162 0.455608} H25 6850 0.0 -1 1 {} H 0.0 {0.494029 0.423288 0.460682} H26 6851 0.0 -1 1 {} H 0.0 {0.489179 0.438842 0.458983} H27 6852 0.0 -1 1 {} H 0.0 {0.486419 0.427708 0.445048} H28 6853 0.0 -1 1 {} H 0.0 {0.512641 0.423853 0.435823} H29 6854 0.0 -1 1 {} H 0.0 {0.498515 0.427557 0.428694} H31 6855 0.0 -1 1 {} H 0.0 {0.52542 0.461425 0.425869} H32 6856 0.0 -1 1 {} H 0.0 {0.46686 0.484718 0.470677} H33 6857 0.0 -1 1 {} H 0.0 {0.466024 0.420114 0.454799} H34 6858 0.0 -1 7 {} N 0.0 {0.544177 0.464538 0.46582} N3 6859 0.0 -1 1 {} H 0.0 {0.538937 0.466483 0.474291} H16 6860 0.0 -1 1 {} H 0.0 {0.552501 0.470914 0.467415} H17 6861 0.0 -1 7 {} N 0.0 {0.511049 0.500453 0.476596} N6 6862 0.0 -1 1 {} H 0.0 {0.502083 0.496277 0.479227} H41 6863 0.0 -1 1 {} H 0.0 {0.518112 0.499096 0.483749} H42 6864 0.0 -1 14 {} Si 0.0 {0.547135 0.641309 0.318894} Si6 6865 0.0 -1 8 {} O 0.0 {0.559187 0.649849 0.323934} O6 6866 0.0 -1 14 {} Si 0.0 {0.566622 0.660221 0.333474} Si7 6867 0.0 -1 8 {} O 0.0 {0.583583 0.674511 0.320054} O7 6868 0.0 -1 14 {} Si 0.0 {0.584331 0.659437 0.315742} Si8 6869 0.0 -1 7 {} N 0.0 {0.578863 0.650771 0.299039} N2 6870 0.0 -1 14 {} Si 0.0 {0.566149 0.657755 0.291383} Si9 6871 0.0 -1 14 {} Si 0.0 {0.582346 0.638166 0.289183} Si10 6872 0.0 -1 6 {} C 0.0 {0.546492 0.622325 0.317104} C3 6873 0.0 -1 7 {} N 0.0 {0.52739 0.231351 0.56049} N 6874 0.0 -1 8 {} O 0.0 {0.580382 0.667963 0.348203} O8 6875 0.0 -1 8 {} O 0.0 {0.544038 0.649967 0.306591} O9 6876 0.0 -1 8 {} O 0.0 {0.534674 0.651537 0.329751} O10 6877 0.0 -1 1 {} H 0.0 {0.599838 0.660784 0.307938} H18 6878 0.0 -1 1 {} H 0.0 {0.593276 0.648163 0.325272} H19 6879 0.0 -1 1 {} H 0.0 {0.56323 0.652363 0.27816} H20 6880 0.0 -1 1 {} H 0.0 {0.553219 0.652199 0.301478} H22 6881 0.0 -1 1 {} H 0.0 {0.570661 0.629692 0.281057} H24 6882 0.0 -1 1 {} H 0.0 {0.589928 0.625079 0.298578} H25 6883 0.0 -1 1 {} H 0.0 {0.555507 0.618611 0.313791} H26 6884 0.0 -1 1 {} H 0.0 {0.539946 0.620108 0.30923} H27 6885 0.0 -1 1 {} H 0.0 {0.54372 0.618074 0.326429} H28 6886 0.0 -1 1 {} H 0.0 {0.516737 0.233215 0.562483} H29 6887 0.0 -1 1 {} H 0.0 {0.53282 0.237066 0.566289} H31 6888 0.0 -1 1 {} H 0.0 {0.57834 0.677703 0.348258} H32 6889 0.0 -1 1 {} H 0.0 {0.562348 0.691921 0.322635} H33 6890 0.0 -1 1 {} H 0.0 {0.63533 0.23921 0.501362} H34 6891 0.0 -1 7 {} N 0.0 {0.567732 0.678729 0.291975} N3 6892 0.0 -1 1 {} H 0.0 {0.558427 0.679991 0.295682} H16 6893 0.0 -1 1 {} H 0.0 {0.575145 0.678838 0.299842} H17 6894 0.0 -1 7 {} N 0.0 {0.676535 0.549507 0.388847} N6 6895 0.0 -1 1 {} H 0.0 {0.679703 0.552859 0.39807} H41 6896 0.0 -1 1 {} H 0.0 {0.670679 0.555964 0.384249} H42 6897 0.0 -1 14 {} Si 0.0 {0.523269 0.323751 0.349426} Si6 6898 0.0 -1 8 {} O 0.0 {0.528873 0.336359 0.356042} O6 6899 0.0 -1 14 {} Si 0.0 {0.537576 0.349884 0.357792} Si7 6900 0.0 -1 8 {} O 0.0 {0.552842 0.341397 0.357041} O7 6901 0.0 -1 14 {} Si 0.0 {0.564084 0.333399 0.365072} Si8 6902 0.0 -1 7 {} N 0.0 {0.565092 0.342715 0.382202} N2 6903 0.0 -1 14 {} Si 0.0 {0.548418 0.342636 0.380836} Si9 6904 0.0 -1 14 {} Si 0.0 {0.563652 0.360033 0.392366} Si10 6905 0.0 -1 6 {} C 0.0 {0.533064 0.308943 0.344784} C3 6906 0.0 -1 7 {} N 0.0 {0.525284 0.368131 0.361606} N 6907 0.0 -1 8 {} O 0.0 {0.532245 0.320849 0.394468} O8 6908 0.0 -1 8 {} O 0.0 {0.512078 0.331377 0.34005} O9 6909 0.0 -1 8 {} O 0.0 {0.512904 0.322854 0.367648} O10 6910 0.0 -1 1 {} H 0.0 {0.560585 0.315826 0.364748} H18 6911 0.0 -1 1 {} H 0.0 {0.576353 0.333782 0.356458} H19 6912 0.0 -1 1 {} H 0.0 {0.540016 0.330742 0.389619} H20 6913 0.0 -1 1 {} H 0.0 {0.790596 0.47186 0.667925} H22 6914 0.0 -1 1 {} H 0.0 {0.554882 0.367816 0.398223} H24 6915 0.0 -1 1 {} H 0.0 {0.565173 0.383277 0.412967} H25 6916 0.0 -1 1 {} H 0.0 {0.529193 0.305071 0.335629} H26 6917 0.0 -1 1 {} H 0.0 {0.531103 0.30117 0.351436} H27 6918 0.0 -1 1 {} H 0.0 {0.543199 0.312 0.34524} H28 6919 0.0 -1 1 {} H 0.0 {0.518847 0.366116 0.369824} H29 6920 0.0 -1 1 {} H 0.0 {0.532363 0.374615 0.365338} H31 6921 0.0 -1 1 {} H 0.0 {0.523887 0.323603 0.388825} H32 6922 0.0 -1 1 {} H 0.0 {0.503411 0.332379 0.345204} H33 6923 0.0 -1 1 {} H 0.0 {0.503497 0.323597 0.364083} H34 6924 0.0 -1 7 {} N 0.0 {0.796335 0.479682 0.66492} N3 6925 0.0 -1 1 {} H 0.0 {0.806086 0.47718 0.66614} H16 6926 0.0 -1 1 {} H 0.0 {0.794417 0.482721 0.655384} H17 6927 0.0 -1 7 {} N 0.0 {0.584557 0.364056 0.396284} N6 6928 0.0 -1 1 {} H 0.0 {0.582605 0.373739 0.399597} H41 6929 0.0 -1 1 {} H 0.0 {0.585217 0.36428 0.386258} H42 6930 0.0 -1 14 {} Si 0.0 {0.503655 0.41288 0.774664} Si6 6931 0.0 -1 8 {} O 0.0 {0.499867 0.426599 0.781287} O6 6932 0.0 -1 14 {} Si 0.0 {0.502458 0.441986 0.781224} Si7 6933 0.0 -1 8 {} O 0.0 {0.496953 0.444331 0.766702} O7 6934 0.0 -1 14 {} Si 0.0 {0.485224 0.449512 0.757131} Si8 6935 0.0 -1 7 {} N 0.0 {0.717643 0.402137 0.432342} N2 6936 0.0 -1 14 {} Si 0.0 {0.706634 0.4048 0.444297} Si9 6937 0.0 -1 14 {} Si 0.0 {0.710443 0.385567 0.42616} Si10 6938 0.0 -1 6 {} C 0.0 {0.516539 0.400144 0.780632} C3 6939 0.0 -1 7 {} N 0.0 {0.47114 0.437438 0.730849} N 6940 0.0 -1 8 {} O 0.0 {0.518211 0.44334 0.779877} O8 6941 0.0 -1 8 {} O 0.0 {0.544436 0.406067 0.771015} O9 6942 0.0 -1 8 {} O 0.0 {0.499899 0.416095 0.759026} O10 6943 0.0 -1 1 {} H 0.0 {0.491983 0.450516 0.74422} H18 6944 0.0 -1 1 {} H 0.0 {0.476409 0.43798 0.756244} H19 6945 0.0 -1 1 {} H 0.0 {0.697465 0.415606 0.435208} H20 6946 0.0 -1 1 {} H 0.0 {0.683397 0.380791 0.41414} H22 6947 0.0 -1 1 {} H 0.0 {0.701485 0.38814 0.411987} H24 6948 0.0 -1 1 {} H 0.0 {0.720375 0.374753 0.423372} H25 6949 0.0 -1 1 {} H 0.0 {0.521024 0.395176 0.772723} H26 6950 0.0 -1 1 {} H 0.0 {0.511199 0.393902 0.786972} H27 6951 0.0 -1 1 {} H 0.0 {0.523836 0.40617 0.785187} H28 6952 0.0 -1 1 {} H 0.0 {0.461721 0.436731 0.72698} H29 6953 0.0 -1 1 {} H 0.0 {0.471043 0.445133 0.738111} H31 6954 0.0 -1 1 {} H 0.0 {0.59028 0.328764 0.404848} H32 6955 0.0 -1 1 {} H 0.0 {0.553993 0.403745 0.773494} H33 6956 0.0 -1 1 {} H 0.0 {0.495321 0.425161 0.759337} H34 6957 0.0 -1 7 {} N 0.0 {0.710827 0.408139 0.462852} N3 6958 0.0 -1 1 {} H 0.0 {0.71499 0.39905 0.465694} H16 6959 0.0 -1 1 {} H 0.0 {0.701756 0.408108 0.467052} H17 6960 0.0 -1 7 {} N 0.0 {0.595275 0.327529 0.39572} N6 6961 0.0 -1 1 {} H 0.0 {0.588475 0.326857 0.388089} H41 6962 0.0 -1 1 {} H 0.0 {0.601031 0.33603 0.394828} H42 6963 0.0 -1 14 {} Si 0.0 {0.483504 0.271844 0.469954} Si6 6964 0.0 -1 8 {} O 0.0 {0.474104 0.263815 0.480606} O6 6965 0.0 -1 14 {} Si 0.0 {0.47516 0.253 0.491033} Si7 6966 0.0 -1 8 {} O 0.0 {0.473231 0.262516 0.503302} O7 6967 0.0 -1 14 {} Si 0.0 {0.476314 0.274672 0.513042} Si8 6968 0.0 -1 7 {} N 0.0 {0.462469 0.284559 0.516218} N2 6969 0.0 -1 14 {} Si 0.0 {0.458339 0.299869 0.512428} Si9 6970 0.0 -1 14 {} Si 0.0 {0.449357 0.277943 0.5237} Si10 6971 0.0 -1 6 {} C 0.0 {0.489298 0.265298 0.453375} C3 6972 0.0 -1 7 {} N 0.0 {0.463685 0.237439 0.488971} N 6973 0.0 -1 8 {} O 0.0 {0.494872 0.248585 0.491447} O8 6974 0.0 -1 8 {} O 0.0 {0.49434 0.276313 0.480639} O9 6975 0.0 -1 8 {} O 0.0 {0.472291 0.290016 0.471653} O10 6976 0.0 -1 1 {} H 0.0 {0.480478 0.269646 0.525527} H18 6977 0.0 -1 1 {} H 0.0 {0.491635 0.28206 0.508545} H19 6978 0.0 -1 1 {} H 0.0 {0.444796 0.307763 0.517375} H20 6979 0.0 -1 1 {} H 0.0 {0.474191 0.309801 0.51312} H22 6980 0.0 -1 1 {} H 0.0 {0.451715 0.261039 0.527608} H24 6981 0.0 -1 1 {} H 0.0 {0.433716 0.27905 0.51619} H25 6982 0.0 -1 1 {} H 0.0 {0.497031 0.271375 0.449735} H26 6983 0.0 -1 1 {} H 0.0 {0.480293 0.266355 0.447993} H27 6984 0.0 -1 1 {} H 0.0 {0.492494 0.255455 0.455079} H28 6985 0.0 -1 1 {} H 0.0 {0.454303 0.24146 0.488477} H29 6986 0.0 -1 1 {} H 0.0 {0.463772 0.232862 0.497982} H31 6987 0.0 -1 1 {} H 0.0 {0.499822 0.254098 0.485127} H32 6988 0.0 -1 1 {} H 0.0 {0.501548 0.26994 0.481516} H33 6989 0.0 -1 1 {} H 0.0 {0.479828 0.29536 0.476235} H34 6990 0.0 -1 7 {} N 0.0 {0.456229 0.302092 0.493882} N3 6991 0.0 -1 1 {} H 0.0 {0.446181 0.304589 0.492036} H16 6992 0.0 -1 1 {} H 0.0 {0.461851 0.309774 0.49035} H17 6993 0.0 -1 7 {} N 0.0 {0.447479 0.283933 0.542701} N6 6994 0.0 -1 1 {} H 0.0 {0.443734 0.27569 0.547493} H41 6995 0.0 -1 1 {} H 0.0 {0.439067 0.289516 0.541163} H42 6996 0.0 -1 14 {} Si 0.0 {0.359415 0.484685 0.628547} Si6 6997 0.0 -1 8 {} O 0.0 {0.350928 0.49548 0.637061} O6 6998 0.0 -1 14 {} Si 0.0 {0.338267 0.50238 0.644183} Si7 6999 0.0 -1 8 {} O 0.0 {0.341908 0.500965 0.659079} O7 7000 0.0 -1 14 {} Si 0.0 {0.346993 0.490138 0.67022} Si8 7001 0.0 -1 7 {} N 0.0 {0.364825 0.4823 0.670973} N2 7002 0.0 -1 14 {} Si 0.0 {0.507201 0.443309 0.2793} Si9 7003 0.0 -1 14 {} Si 0.0 {0.372479 0.495101 0.664115} Si10 7004 0.0 -1 6 {} C 0.0 {0.35189 0.467694 0.626766} C3 7005 0.0 -1 7 {} N 0.0 {0.339614 0.521431 0.640173} N 7006 0.0 -1 8 {} O 0.0 {0.327982 0.490817 0.64395} O8 7007 0.0 -1 8 {} O 0.0 {0.377232 0.485147 0.637047} O9 7008 0.0 -1 8 {} O 0.0 {0.361974 0.494633 0.617045} O10 7009 0.0 -1 1 {} H 0.0 {0.343666 0.497517 0.681582} H18 7010 0.0 -1 1 {} H 0.0 {0.339079 0.47535 0.667964} H19 7011 0.0 -1 1 {} H 0.0 {0.51194 0.431826 0.285204} H20 7012 0.0 -1 1 {} H 0.0 {0.365751 0.4826 0.68075} H22 7013 0.0 -1 1 {} H 0.0 {0.364757 0.510207 0.664437} H24 7014 0.0 -1 1 {} H 0.0 {0.375684 0.48997 0.648869} H25 7015 0.0 -1 1 {} H 0.0 {0.359598 0.462583 0.63198} H26 7016 0.0 -1 1 {} H 0.0 {0.350267 0.466232 0.61627} H27 7017 0.0 -1 1 {} H 0.0 {0.342719 0.466188 0.632315} H28 7018 0.0 -1 1 {} H 0.0 {0.348954 0.525138 0.640995} H29 7019 0.0 -1 1 {} H 0.0 {0.33453 0.52705 0.646935} H31 7020 0.0 -1 1 {} H 0.0 {0.327882 0.483833 0.651025} H32 7021 0.0 -1 1 {} H 0.0 {0.383342 0.493212 0.633713} H33 7022 0.0 -1 1 {} H 0.0 {0.371225 0.498498 0.618097} H34 7023 0.0 -1 7 {} N 0.0 {0.490308 0.4387 0.27147} N3 7024 0.0 -1 1 {} H 0.0 {0.493577 0.43258 0.264187} H16 7025 0.0 -1 1 {} H 0.0 {0.48728 0.431607 0.278666} H17 7026 0.0 -1 7 {} N 0.0 {0.387036 0.499448 0.674856} N6 7027 0.0 -1 1 {} H 0.0 {0.387868 0.509135 0.672006} H41 7028 0.0 -1 1 {} H 0.0 {0.39352 0.49467 0.668697} H42 7029 0.0 -1 14 {} Si 0.0 {0.554692 0.326387 0.670626} Si6 7030 0.0 -1 8 {} O 0.0 {0.569822 0.329952 0.670798} O6 7031 0.0 -1 14 {} Si 0.0 {0.553444 0.329635 0.698044} Si7 7032 0.0 -1 8 {} O 0.0 {0.54592 0.342213 0.693851} O7 7033 0.0 -1 14 {} Si 0.0 {0.585664 0.398792 0.692406} Si8 7034 0.0 -1 7 {} N 0.0 {0.577532 0.385389 0.695004} N2 7035 0.0 -1 14 {} Si 0.0 {0.571362 0.381273 0.708924} Si9 7036 0.0 -1 14 {} Si 0.0 {0.56655 0.289849 0.716483} Si10 7037 0.0 -1 6 {} C 0.0 {0.542507 0.332976 0.660488} C3 7038 0.0 -1 7 {} N 0.0 {0.502108 0.252401 0.5668} N 7039 0.0 -1 8 {} O 0.0 {0.538794 0.400916 0.635425} O8 7040 0.0 -1 8 {} O 0.0 {0.554435 0.3115 0.67646} O9 7041 0.0 -1 8 {} O 0.0 {0.554742 0.357399 0.651012} O10 7042 0.0 -1 1 {} H 0.0 {0.579117 0.40223 0.677269} H18 7043 0.0 -1 1 {} H 0.0 {0.528674 0.31453 0.757956} H19 7044 0.0 -1 1 {} H 0.0 {0.563961 0.394112 0.716833} H20 7045 0.0 -1 1 {} H 0.0 {0.580609 0.373416 0.718771} H22 7046 0.0 -1 1 {} H 0.0 {0.571607 0.299989 0.710318} H24 7047 0.0 -1 1 {} H 0.0 {0.575558 0.277605 0.721054} H25 7048 0.0 -1 1 {} H 0.0 {0.549697 0.346008 0.655107} H26 7049 0.0 -1 1 {} H 0.0 {0.533824 0.336585 0.665415} H27 7050 0.0 -1 1 {} H 0.0 {0.541696 0.326572 0.652101} H28 7051 0.0 -1 1 {} H 0.0 {0.512261 0.25134 0.567438} H29 7052 0.0 -1 1 {} H 0.0 {0.498777 0.243453 0.570233} H31 7053 0.0 -1 1 {} H 0.0 {0.533866 0.398664 0.627017} H32 7054 0.0 -1 1 {} H 0.0 {0.563551 0.307925 0.677326} H33 7055 0.0 -1 1 {} H 0.0 {0.563851 0.354439 0.648847} H34 7056 0.0 -1 7 {} N 0.0 {0.55481 0.369484 0.705014} N3 7057 0.0 -1 1 {} H 0.0 {0.554811 0.364412 0.713715} H16 7058 0.0 -1 1 {} H 0.0 {0.547323 0.37597 0.705131} H17 7059 0.0 -1 7 {} N 0.0 {0.477135 0.609304 0.58257} N6 7060 0.0 -1 1 {} H 0.0 {0.473521 0.610816 0.592184} H41 7061 0.0 -1 1 {} H 0.0 {0.46818 0.610087 0.577047} H42 7062 0.0 -1 14 {} Si 0.0 {0.58827 0.636447 0.416551} Si6 7063 0.0 -1 8 {} O 0.0 {0.593868 0.644272 0.404175} O6 7064 0.0 -1 14 {} Si 0.0 {0.596868 0.651924 0.391232} Si7 7065 0.0 -1 8 {} O 0.0 {0.582563 0.652825 0.384298} O7 7066 0.0 -1 14 {} Si 0.0 {0.57136 0.660876 0.37587} Si8 7067 0.0 -1 7 {} N 0.0 {0.555917 0.658102 0.369444} N2 7068 0.0 -1 14 {} Si 0.0 {0.541913 0.66795 0.367217} Si9 7069 0.0 -1 14 {} Si 0.0 {0.559838 0.638791 0.367159} Si10 7070 0.0 -1 6 {} C 0.0 {0.594392 0.620212 0.420828} C3 7071 0.0 -1 7 {} N 0.0 {0.608916 0.66739 0.393445} N 7072 0.0 -1 8 {} O 0.0 {0.60355 0.642008 0.381458} O8 7073 0.0 -1 8 {} O 0.0 {0.567904 0.640098 0.410765} O9 7074 0.0 -1 8 {} O 0.0 {0.588936 0.648072 0.426515} O10 7075 0.0 -1 1 {} H 0.0 {0.576027 0.664629 0.358616} H18 7076 0.0 -1 1 {} H 0.0 {0.565166 0.694243 0.368237} H19 7077 0.0 -1 1 {} H 0.0 {0.537651 0.675329 0.380538} H20 7078 0.0 -1 1 {} H 0.0 {0.544621 0.678921 0.359862} H22 7079 0.0 -1 1 {} H 0.0 {0.55497 0.632928 0.378946} H24 7080 0.0 -1 1 {} H 0.0 {0.572299 0.636781 0.356404} H25 7081 0.0 -1 1 {} H 0.0 {0.597206 0.619958 0.430912} H26 7082 0.0 -1 1 {} H 0.0 {0.601891 0.617397 0.413183} H27 7083 0.0 -1 1 {} H 0.0 {0.567585 0.612794 0.414591} H28 7084 0.0 -1 1 {} H 0.0 {0.602718 0.674239 0.397185} H29 7085 0.0 -1 1 {} H 0.0 {0.611738 0.670927 0.384331} H31 7086 0.0 -1 1 {} H 0.0 {0.601375 0.633028 0.383013} H32 7087 0.0 -1 1 {} H 0.0 {0.570639 0.64655 0.404128} H33 7088 0.0 -1 1 {} H 0.0 {0.597296 0.65376 0.427553} H34 7089 0.0 -1 7 {} N 0.0 {0.526945 0.658352 0.362394} N3 7090 0.0 -1 1 {} H 0.0 {0.529839 0.656058 0.35324} H16 7091 0.0 -1 1 {} H 0.0 {0.519816 0.665579 0.361862} H17 7092 0.0 -1 7 {} N 0.0 {0.545734 0.633989 0.354491} N6 7093 0.0 -1 1 {} H 0.0 {0.547614 0.642214 0.34868} H41 7094 0.0 -1 1 {} H 0.0 {0.53824 0.63621 0.360918} H42 7095 0.0 -1 14 {} Si 0.0 {0.409359 0.658276 0.684922} Si6 7096 0.0 -1 8 {} O 0.0 {0.397748 0.668815 0.682648} O6 7097 0.0 -1 14 {} Si 0.0 {0.393017 0.680026 0.673354} Si7 7098 0.0 -1 8 {} O 0.0 {0.38489 0.671799 0.662603} O7 7099 0.0 -1 14 {} Si 0.0 {0.383668 0.658359 0.655026} Si8 7100 0.0 -1 7 {} N 0.0 {0.366453 0.647769 0.653921} N2 7101 0.0 -1 14 {} Si 0.0 {0.357312 0.660652 0.655635} Si9 7102 0.0 -1 14 {} Si 0.0 {0.357698 0.634321 0.657033} Si10 7103 0.0 -1 6 {} C 0.0 {0.42758 0.661952 0.685864} C3 7104 0.0 -1 7 {} N 0.0 {0.388002 0.698603 0.683289} N 7105 0.0 -1 8 {} O 0.0 {0.405287 0.683198 0.663606} O8 7106 0.0 -1 8 {} O 0.0 {0.403083 0.642515 0.672353} O9 7107 0.0 -1 8 {} O 0.0 {0.400562 0.651134 0.696456} O10 7108 0.0 -1 1 {} H 0.0 {0.389226 0.66255 0.641292} H18 7109 0.0 -1 1 {} H 0.0 {0.395223 0.648245 0.665348} H19 7110 0.0 -1 1 {} H 0.0 {0.640158 0.488635 0.663694} H20 7111 0.0 -1 1 {} H 0.0 {0.356086 0.669023 0.667655} H22 7112 0.0 -1 1 {} H 0.0 {0.364283 0.642064 0.633777} H24 7113 0.0 -1 1 {} H 0.0 {0.337885 0.635257 0.648741} H25 7114 0.0 -1 1 {} H 0.0 {0.427745 0.668573 0.694506} H26 7115 0.0 -1 1 {} H 0.0 {0.432403 0.667229 0.677232} H27 7116 0.0 -1 1 {} H 0.0 {0.431671 0.652132 0.688081} H28 7117 0.0 -1 1 {} H 0.0 {0.378567 0.702514 0.682865} H29 7118 0.0 -1 1 {} H 0.0 {0.392047 0.699883 0.692916} H31 7119 0.0 -1 1 {} H 0.0 {0.407211 0.675229 0.65854} H32 7120 0.0 -1 1 {} H 0.0 {0.397368 0.636045 0.677511} H33 7121 0.0 -1 1 {} H 0.0 {0.397041 0.642999 0.692933} H34 7122 0.0 -1 7 {} N 0.0 {0.354255 0.672011 0.638027} N3 7123 0.0 -1 1 {} H 0.0 {0.344155 0.672097 0.638085} H16 7124 0.0 -1 1 {} H 0.0 {0.356897 0.665539 0.630771} H17 7125 0.0 -1 7 {} N 0.0 {0.366696 0.624327 0.671328} N6 7126 0.0 -1 1 {} H 0.0 {0.364585 0.62776 0.680978} H41 7127 0.0 -1 1 {} H 0.0 {0.376868 0.625938 0.670016} H42 7128 0.0 -1 14 {} Si 0.0 {0.418965 0.549293 0.599844} Si6 7129 0.0 -1 8 {} O 0.0 {0.504535 0.528036 0.282661} O6 7130 0.0 -1 14 {} Si 0.0 {0.494694 0.527349 0.270584} Si7 7131 0.0 -1 8 {} O 0.0 {0.490366 0.541925 0.268898} O7 7132 0.0 -1 14 {} Si 0.0 {0.494746 0.556089 0.263768} Si8 7133 0.0 -1 7 {} N 0.0 {0.243147 0.495113 0.624442} N2 7134 0.0 -1 14 {} Si 0.0 {0.253742 0.479084 0.630156} Si9 7135 0.0 -1 14 {} Si 0.0 {0.233201 0.513638 0.625513} Si10 7136 0.0 -1 6 {} C 0.0 {0.418899 0.541919 0.584164} C3 7137 0.0 -1 7 {} N 0.0 {0.50038 0.519171 0.255891} N 7138 0.0 -1 8 {} O 0.0 {0.477132 0.520412 0.279905} O8 7139 0.0 -1 8 {} O 0.0 {0.545132 0.389736 0.337927} O9 7140 0.0 -1 8 {} O 0.0 {0.402492 0.550271 0.715056} O10 7141 0.0 -1 1 {} H 0.0 {0.494139 0.554314 0.250666} H18 7142 0.0 -1 1 {} H 0.0 {0.525587 0.534087 0.271372} H19 7143 0.0 -1 1 {} H 0.0 {0.24968 0.47492 0.642275} H20 7144 0.0 -1 1 {} H 0.0 {0.214343 0.493045 0.597403} H22 7145 0.0 -1 1 {} H 0.0 {0.648961 0.638527 0.422054} H24 7146 0.0 -1 1 {} H 0.0 {0.220675 0.511721 0.619126} H25 7147 0.0 -1 1 {} H 0.0 {0.427294 0.535634 0.583395} H26 7148 0.0 -1 1 {} H 0.0 {0.236708 0.490039 0.618157} H27 7149 0.0 -1 1 {} H 0.0 {0.4184 0.548612 0.575451} H28 7150 0.0 -1 1 {} H 0.0 {0.499473 0.527632 0.248991} H29 7151 0.0 -1 1 {} H 0.0 {0.493573 0.512339 0.251688} H31 7152 0.0 -1 1 {} H 0.0 {0.47986 0.515523 0.288213} H32 7153 0.0 -1 1 {} H 0.0 {0.538097 0.399562 0.334273} H33 7154 0.0 -1 1 {} H 0.0 {0.402111 0.559777 0.712014} H34 7155 0.0 -1 7 {} N 0.0 {0.269707 0.485628 0.632994} N3 7156 0.0 -1 1 {} H 0.0 {0.275884 0.481499 0.625956} H16 7157 0.0 -1 1 {} H 0.0 {0.26889 0.495572 0.630542} H17 7158 0.0 -1 7 {} N 0.0 {0.248311 0.526969 0.617949} N6 7159 0.0 -1 1 {} H 0.0 {0.248785 0.535041 0.623948} H41 7160 0.0 -1 1 {} H 0.0 {0.241861 0.529164 0.609894} H42 7161 0.0 -1 14 {} Si 0.0 {0.364328 0.599445 0.535021} Si6 7162 0.0 -1 8 {} O 0.0 {0.370485 0.585019 0.536147} O6 7163 0.0 -1 14 {} Si 0.0 {0.28544 0.597099 0.555411} Si7 7164 0.0 -1 8 {} O 0.0 {0.301334 0.515089 0.533337} O7 7165 0.0 -1 14 {} Si 0.0 {0.308103 0.52534 0.549525} Si8 7166 0.0 -1 7 {} N 0.0 {0.342224 0.551526 0.538348} N2 7167 0.0 -1 14 {} Si 0.0 {0.32118 0.507455 0.569871} Si9 7168 0.0 -1 14 {} Si 0.0 {0.430244 0.528162 0.615273} Si10 7169 0.0 -1 6 {} C 0.0 {0.352206 0.60163 0.522679} C3 7170 0.0 -1 7 {} N 0.0 {0.445553 0.510139 0.474214} N 7171 0.0 -1 8 {} O 0.0 {0.274233 0.605535 0.561126} O8 7172 0.0 -1 8 {} O 0.0 {0.382623 0.610157 0.535602} O9 7173 0.0 -1 8 {} O 0.0 {0.32649 0.631819 0.607406} O10 7174 0.0 -1 1 {} H 0.0 {0.472677 0.552678 0.581733} H18 7175 0.0 -1 1 {} H 0.0 {0.301647 0.506325 0.536605} H19 7176 0.0 -1 1 {} H 0.0 {0.268302 0.56512 0.669167} H20 7177 0.0 -1 1 {} H 0.0 {0.334816 0.501739 0.566866} H22 7178 0.0 -1 1 {} H 0.0 {0.752624 0.231392 0.963227} H24 7179 0.0 -1 1 {} H 0.0 {0.404976 0.532592 0.583261} H25 7180 0.0 -1 1 {} H 0.0 {0.344381 0.594557 0.524562} H26 7181 0.0 -1 1 {} H 0.0 {0.348234 0.61155 0.523037} H27 7182 0.0 -1 1 {} H 0.0 {0.356827 0.60482 0.547128} H28 7183 0.0 -1 1 {} H 0.0 {0.449303 0.51967 0.475053} H29 7184 0.0 -1 1 {} H 0.0 {0.44331 0.50998 0.464584} H31 7185 0.0 -1 1 {} H 0.0 {0.264433 0.603334 0.554884} H32 7186 0.0 -1 1 {} H 0.0 {0.389289 0.602401 0.535416} H33 7187 0.0 -1 1 {} H 0.0 {0.319407 0.627956 0.601688} H34 7188 0.0 -1 7 {} N 0.0 {0.317749 0.494182 0.55335} N3 7189 0.0 -1 1 {} H 0.0 {0.326047 0.488739 0.555798} H16 7190 0.0 -1 1 {} H 0.0 {0.320082 0.497775 0.543557} H17 7191 0.0 -1 7 {} N 0.0 {0.39506 0.474691 0.584007} N6 7192 0.0 -1 1 {} H 0.0 {0.404625 0.476929 0.580103} H41 7193 0.0 -1 1 {} H 0.0 {0.388104 0.476397 0.576635} H42 7194 0.0 -1 14 {} Si 0.0 {0.330849 0.431197 0.362024} Si6 7195 0.0 -1 8 {} O 0.0 {0.315948 0.432964 0.377318} O6 7196 0.0 -1 14 {} Si 0.0 {0.306767 0.449979 0.370965} Si7 7197 0.0 -1 8 {} O 0.0 {0.317315 0.45774 0.379882} O7 7198 0.0 -1 14 {} Si 0.0 {0.322822 0.459002 0.394569} Si8 7199 0.0 -1 7 {} N 0.0 {0.330109 0.445951 0.400422} N2 7200 0.0 -1 14 {} Si 0.0 {0.333586 0.434919 0.411422} Si9 7201 0.0 -1 14 {} Si 0.0 {0.351982 0.378731 0.445784} Si10 7202 0.0 -1 6 {} C 0.0 {0.328833 0.428998 0.345476} C3 7203 0.0 -1 7 {} N 0.0 {0.302847 0.452561 0.354029} N 7204 0.0 -1 8 {} O 0.0 {0.296241 0.449892 0.382572} O8 7205 0.0 -1 8 {} O 0.0 {0.343584 0.433065 0.371564} O9 7206 0.0 -1 8 {} O 0.0 {0.334388 0.413095 0.351075} O10 7207 0.0 -1 1 {} H 0.0 {0.334159 0.471518 0.391069} H18 7208 0.0 -1 1 {} H 0.0 {0.892922 0.454738 0.545771} H19 7209 0.0 -1 1 {} H 0.0 {0.330427 0.44409 0.429127} H20 7210 0.0 -1 1 {} H 0.0 {0.329055 0.41931 0.406708} H22 7211 0.0 -1 1 {} H 0.0 {0.212139 0.507613 0.481764} H24 7212 0.0 -1 1 {} H 0.0 {0.603478 0.263236 0.530905} H25 7213 0.0 -1 1 {} H 0.0 {0.322934 0.436204 0.384316} H26 7214 0.0 -1 1 {} H 0.0 {0.318635 0.430405 0.341913} H27 7215 0.0 -1 1 {} H 0.0 {0.335733 0.435698 0.340842} H28 7216 0.0 -1 1 {} H 0.0 {0.293165 0.456216 0.352671} H29 7217 0.0 -1 1 {} H 0.0 {0.309449 0.45881 0.348993} H31 7218 0.0 -1 1 {} H 0.0 {0.296938 0.441733 0.387949} H32 7219 0.0 -1 1 {} H 0.0 {0.345449 0.424294 0.375711} H33 7220 0.0 -1 1 {} H 0.0 {0.412359 0.475985 0.342756} H34 7221 0.0 -1 7 {} N 0.0 {0.35294 0.43269 0.409564} N3 7222 0.0 -1 1 {} H 0.0 {0.357456 0.436553 0.417247} H16 7223 0.0 -1 1 {} H 0.0 {0.355073 0.436274 0.400172} H17 7224 0.0 -1 7 {} N 0.0 {0.348911 0.392002 0.41665} N6 7225 0.0 -1 1 {} H 0.0 {0.346594 0.373347 0.435662} H41 7226 0.0 -1 1 {} H 0.0 {0.356544 0.415827 0.410155} H42 7227 0.0 -1 14 {} Si 0.0 {0.43025 0.449265 0.641864} Si6 7228 0.0 -1 8 {} O 0.0 {0.413651 0.438946 0.648043} O6 7229 0.0 -1 14 {} Si 0.0 {0.414793 0.42513 0.655613} Si7 7230 0.0 -1 8 {} O 0.0 {0.429257 0.418473 0.652515} O7 7231 0.0 -1 14 {} Si 0.0 {0.442387 0.421637 0.643274} Si8 7232 0.0 -1 7 {} N 0.0 {0.446774 0.409365 0.628854} N2 7233 0.0 -1 14 {} Si 0.0 {0.448226 0.403692 0.613558} Si9 7234 0.0 -1 14 {} Si 0.0 {0.441702 0.393999 0.637655} Si10 7235 0.0 -1 6 {} C 0.0 {0.431528 0.457791 0.625206} C3 7236 0.0 -1 7 {} N 0.0 {0.405756 0.42348 0.670171} N 7237 0.0 -1 8 {} O 0.0 {0.40363 0.414939 0.641551} O8 7238 0.0 -1 8 {} O 0.0 {0.422652 0.426537 0.621465} O9 7239 0.0 -1 8 {} O 0.0 {0.435592 0.454504 0.655778} O10 7240 0.0 -1 1 {} H 0.0 {0.436781 0.436729 0.641166} H18 7241 0.0 -1 1 {} H 0.0 {0.455224 0.422693 0.652707} H19 7242 0.0 -1 1 {} H 0.0 {0.438641 0.397424 0.607312} H20 7243 0.0 -1 1 {} H 0.0 {0.448465 0.419212 0.605382} H22 7244 0.0 -1 1 {} H 0.0 {0.432216 0.383673 0.630617} H24 7245 0.0 -1 1 {} H 0.0 {0.433091 0.399166 0.648728} H25 7246 0.0 -1 1 {} H 0.0 {0.433323 0.468312 0.626878} H26 7247 0.0 -1 1 {} H 0.0 {0.422101 0.455546 0.61989} H27 7248 0.0 -1 1 {} H 0.0 {0.440594 0.453941 0.620817} H28 7249 0.0 -1 1 {} H 0.0 {0.400056 0.431154 0.672788} H29 7250 0.0 -1 1 {} H 0.0 {0.399709 0.415153 0.670156} H31 7251 0.0 -1 1 {} H 0.0 {0.396221 0.420829 0.638502} H32 7252 0.0 -1 1 {} H 0.0 {0.416693 0.428278 0.629566} H33 7253 0.0 -1 1 {} H 0.0 {0.438736 0.463907 0.654533} H34 7254 0.0 -1 7 {} N 0.0 {0.465977 0.400957 0.606718} N3 7255 0.0 -1 1 {} H 0.0 {0.470117 0.409728 0.610961} H16 7256 0.0 -1 1 {} H 0.0 {0.468587 0.393803 0.613802} H17 7257 0.0 -1 7 {} N 0.0 {0.45729 0.383424 0.642392} N6 7258 0.0 -1 1 {} H 0.0 {0.456281 0.382339 0.652578} H41 7259 0.0 -1 1 {} H 0.0 {0.46373 0.390967 0.641447} H42 7260 0.0 -1 14 {} Si 0.0 {0.357996 0.594335 0.266688} Si6 7261 0.0 -1 8 {} O 0.0 {0.356664 0.582476 0.257108} O6 7262 0.0 -1 14 {} Si 0.0 {0.364505 0.562999 0.259905} Si7 7263 0.0 -1 8 {} O 0.0 {0.351099 0.487667 0.26056} O7 7264 0.0 -1 14 {} Si 0.0 {0.359333 0.473209 0.2478} Si8 7265 0.0 -1 7 {} N 0.0 {0.648145 0.602291 0.420736} N2 7266 0.0 -1 14 {} Si 0.0 {0.63148 0.59995 0.421307} Si9 7267 0.0 -1 14 {} Si 0.0 {0.644205 0.60995 0.402568} Si10 7268 0.0 -1 6 {} C 0.0 {0.362989 0.610058 0.264828} C3 7269 0.0 -1 7 {} N 0.0 {0.662745 0.540635 0.359269} N 7270 0.0 -1 8 {} O 0.0 {0.342786 0.543058 0.29459} O8 7271 0.0 -1 8 {} O 0.0 {0.343033 0.635604 0.45155} O9 7272 0.0 -1 8 {} O 0.0 {0.339438 0.419094 0.608826} O10 7273 0.0 -1 1 {} H 0.0 {0.357613 0.482696 0.268542} H18 7274 0.0 -1 1 {} H 0.0 {0.370426 0.47857 0.242338} H19 7275 0.0 -1 1 {} H 0.0 {0.625501 0.613818 0.429947} H20 7276 0.0 -1 1 {} H 0.0 {0.621035 0.599892 0.40848} H22 7277 0.0 -1 1 {} H 0.0 {0.629106 0.631518 0.433186} H24 7278 0.0 -1 1 {} H 0.0 {0.613208 0.633822 0.401335} H25 7279 0.0 -1 1 {} H 0.0 {0.478432 0.220134 0.488472} H26 7280 0.0 -1 1 {} H 0.0 {0.519669 0.216307 0.377927} H27 7281 0.0 -1 1 {} H 0.0 {0.368017 0.618786 0.265865} H28 7282 0.0 -1 1 {} H 0.0 {0.668275 0.537949 0.350608} H29 7283 0.0 -1 1 {} H 0.0 {0.669983 0.542604 0.365995} H31 7284 0.0 -1 1 {} H 0.0 {0.402983 0.521505 0.26059} H32 7285 0.0 -1 1 {} H 0.0 {0.349688 0.629584 0.454765} H33 7286 0.0 -1 1 {} H 0.0 {0.335397 0.426297 0.602523} H34 7287 0.0 -1 7 {} N 0.0 {0.63053 0.582168 0.428555} N3 7288 0.0 -1 1 {} H 0.0 {0.629692 0.577316 0.419778} H16 7289 0.0 -1 1 {} H 0.0 {0.64067 0.580897 0.429824} H17 7290 0.0 -1 7 {} N 0.0 {0.660952 0.567934 0.340586} N6 7291 0.0 -1 1 {} H 0.0 {0.380159 0.427632 0.356354} H41 7292 0.0 -1 1 {} H 0.0 {0.348259 0.422378 0.610007} H42 7293 0.0 -1 14 {} Si 0.0 {0.357918 0.505734 0.298598} Si6 7294 0.0 -1 8 {} O 0.0 {0.366529 0.507698 0.285491} O6 7295 0.0 -1 14 {} Si 0.0 {0.372948 0.513809 0.272018} Si7 7296 0.0 -1 8 {} O 0.0 {0.387931 0.511927 0.277818} O7 7297 0.0 -1 14 {} Si 0.0 {0.402069 0.518394 0.277213} Si8 7298 0.0 -1 7 {} N 0.0 {0.350992 0.530562 0.236462} N2 7299 0.0 -1 14 {} Si 0.0 {0.338726 0.539674 0.231988} Si9 7300 0.0 -1 14 {} Si 0.0 {0.346923 0.540397 0.253266} Si10 7301 0.0 -1 6 {} C 0.0 {0.366049 0.505518 0.316434} C3 7302 0.0 -1 7 {} N 0.0 {0.369569 0.511568 0.252787} N 7303 0.0 -1 8 {} O 0.0 {0.372062 0.529175 0.275861} O8 7304 0.0 -1 8 {} O 0.0 {0.34873 0.487225 0.333742} O9 7305 0.0 -1 8 {} O 0.0 {0.345137 0.51509 0.294694} O10 7306 0.0 -1 1 {} H 0.0 {0.344929 0.534349 0.299458} H18 7307 0.0 -1 1 {} H 0.0 {0.348965 0.521793 0.241908} H19 7308 0.0 -1 1 {} H 0.0 {0.541465 0.251174 0.303644} H20 7309 0.0 -1 1 {} H 0.0 {0.342915 0.551939 0.223866} H22 7310 0.0 -1 1 {} H 0.0 {0.3332 0.545981 0.245246} H24 7311 0.0 -1 1 {} H 0.0 {0.354746 0.551046 0.25623} H25 7312 0.0 -1 1 {} H 0.0 {0.374286 0.499061 0.316406} H26 7313 0.0 -1 1 {} H 0.0 {0.358731 0.501001 0.322684} H27 7314 0.0 -1 1 {} H 0.0 {0.368135 0.51574 0.319155} H28 7315 0.0 -1 1 {} H 0.0 {0.378962 0.510663 0.249825} H29 7316 0.0 -1 1 {} H 0.0 {0.36642 0.52048 0.24998} H31 7317 0.0 -1 1 {} H 0.0 {0.37534 0.530786 0.284789} H32 7318 0.0 -1 1 {} H 0.0 {0.340249 0.484872 0.337376} H33 7319 0.0 -1 1 {} H 0.0 {0.346833 0.518964 0.28565} H34 7320 0.0 -1 7 {} N 0.0 {0.532986 0.650141 0.646306} N3 7321 0.0 -1 1 {} H 0.0 {0.524701 0.649923 0.652784} H16 7322 0.0 -1 1 {} H 0.0 {0.536979 0.659581 0.646343} H17 7323 0.0 -1 7 {} N 0.0 {0.343489 0.528457 0.267832} N6 7324 0.0 -1 1 {} H 0.0 {0.353224 0.527431 0.271335} H41 7325 0.0 -1 1 {} H 0.0 {0.341357 0.520871 0.26189} H42 7326 0.0 -1 14 {} Si 0.0 {0.580933 0.564012 0.479257} Si6 7327 0.0 -1 8 {} O 0.0 {0.578715 0.552171 0.469627} O6 7328 0.0 -1 14 {} Si 0.0 {0.571113 0.540418 0.462616} Si7 7329 0.0 -1 8 {} O 0.0 {0.571394 0.530308 0.474874} O7 7330 0.0 -1 14 {} Si 0.0 {0.593775 0.514265 0.467444} Si8 7331 0.0 -1 7 {} N 0.0 {0.6035 0.504832 0.457904} N2 7332 0.0 -1 14 {} Si 0.0 {0.596078 0.490508 0.459234} Si9 7333 0.0 -1 14 {} Si 0.0 {0.610427 0.516002 0.448001} Si10 7334 0.0 -1 6 {} C 0.0 {0.580413 0.560863 0.497899} C3 7335 0.0 -1 7 {} N 0.0 {0.56043 0.541054 0.448911} N 7336 0.0 -1 8 {} O 0.0 {0.587033 0.53173 0.44158} O8 7337 0.0 -1 8 {} O 0.0 {0.569011 0.576956 0.469648} O9 7338 0.0 -1 8 {} O 0.0 {0.594324 0.568144 0.472269} O10 7339 0.0 -1 1 {} H 0.0 {0.59645 0.506576 0.482433} H18 7340 0.0 -1 1 {} H 0.0 {0.57821 0.515324 0.465207} H19 7341 0.0 -1 1 {} H 0.0 {0.581245 0.488483 0.456384} H20 7342 0.0 -1 1 {} H 0.0 {0.603145 0.483791 0.444354} H22 7343 0.0 -1 1 {} H 0.0 {0.621642 0.52022 0.458609} H24 7344 0.0 -1 1 {} H 0.0 {0.596863 0.526355 0.444696} H25 7345 0.0 -1 1 {} H 0.0 {0.57303 0.56656 0.503017} H26 7346 0.0 -1 1 {} H 0.0 {0.589998 0.563476 0.501929} H27 7347 0.0 -1 1 {} H 0.0 {0.578064 0.551032 0.499503} H28 7348 0.0 -1 1 {} H 0.0 {0.551253 0.536788 0.451062} H29 7349 0.0 -1 1 {} H 0.0 {0.563324 0.533889 0.442101} H31 7350 0.0 -1 1 {} H 0.0 {0.582715 0.535151 0.451671} H32 7351 0.0 -1 1 {} H 0.0 {0.569803 0.574468 0.459859} H33 7352 0.0 -1 1 {} H 0.0 {0.601625 0.562155 0.475354} H34 7353 0.0 -1 7 {} N 0.0 {0.600938 0.478619 0.474576} N3 7354 0.0 -1 1 {} H 0.0 {0.609582 0.483989 0.477024} H16 7355 0.0 -1 1 {} H 0.0 {0.605452 0.471222 0.468743} H17 7356 0.0 -1 7 {} N 0.0 {0.616604 0.50836 0.431328} N6 7357 0.0 -1 1 {} H 0.0 {0.613432 0.498611 0.430357} H41 7358 0.0 -1 1 {} H 0.0 {0.626371 0.508572 0.433246} H42 7359 0.0 -1 14 {} Si 0.0 {0.378223 0.4338 0.628921} Si6 7360 0.0 -1 8 {} O 0.0 {0.373795 0.423725 0.617317} O6 7361 0.0 -1 14 {} Si 0.0 {0.376902 0.416045 0.603692} Si7 7362 0.0 -1 8 {} O 0.0 {0.392733 0.416734 0.604099} O7 7363 0.0 -1 14 {} Si 0.0 {0.406876 0.417483 0.598712} Si8 7364 0.0 -1 7 {} N 0.0 {0.414617 0.431407 0.588253} N2 7365 0.0 -1 14 {} Si 0.0 {0.401379 0.440798 0.588088} Si9 7366 0.0 -1 14 {} Si 0.0 {0.427617 0.438342 0.581639} Si10 7367 0.0 -1 6 {} C 0.0 {0.392011 0.446218 0.627974} C3 7368 0.0 -1 7 {} N 0.0 {0.363627 0.400821 0.601912} N 7369 0.0 -1 8 {} O 0.0 {0.375049 0.429082 0.595057} O8 7370 0.0 -1 8 {} O 0.0 {0.377577 0.423862 0.641184} O9 7371 0.0 -1 8 {} O 0.0 {0.358803 0.439115 0.628953} O10 7372 0.0 -1 1 {} H 0.0 {0.41575 0.42234 0.612622} H18 7373 0.0 -1 1 {} H 0.0 {0.41233 0.399509 0.585304} H19 7374 0.0 -1 1 {} H 0.0 {0.384969 0.433021 0.59224} H20 7375 0.0 -1 1 {} H 0.0 {0.402434 0.451913 0.599866} H22 7376 0.0 -1 1 {} H 0.0 {0.439692 0.433198 0.592931} H24 7377 0.0 -1 1 {} H 0.0 {0.431212 0.43051 0.568147} H25 7378 0.0 -1 1 {} H 0.0 {0.391032 0.451176 0.637481} H26 7379 0.0 -1 1 {} H 0.0 {0.389608 0.453501 0.619453} H27 7380 0.0 -1 1 {} H 0.0 {0.401995 0.441901 0.627508} H28 7381 0.0 -1 1 {} H 0.0 {0.353815 0.404958 0.603001} H29 7382 0.0 -1 1 {} H 0.0 {0.364268 0.392072 0.607055} H31 7383 0.0 -1 1 {} H 0.0 {0.39411 0.481228 0.591604} H32 7384 0.0 -1 1 {} H 0.0 {0.360749 0.414011 0.637857} H33 7385 0.0 -1 1 {} H 0.0 {0.354963 0.436173 0.620032} H34 7386 0.0 -1 7 {} N 0.0 {0.390574 0.446723 0.570189} N3 7387 0.0 -1 1 {} H 0.0 {0.381385 0.450074 0.574215} H16 7388 0.0 -1 1 {} H 0.0 {0.393321 0.441476 0.561355} H17 7389 0.0 -1 7 {} N 0.0 {0.451202 0.368861 0.606583} N6 7390 0.0 -1 1 {} H 0.0 {0.453476 0.361752 0.599705} H41 7391 0.0 -1 1 {} H 0.0 {0.45741 0.367891 0.614581} H42 7392 0.0 -1 14 {} Si 0.0 {0.551456 0.461792 0.390353} Si6 7393 0.0 -1 8 {} O 0.0 {0.535658 0.464864 0.390227} O6 7394 0.0 -1 14 {} Si 0.0 {0.522692 0.463277 0.400048} Si7 7395 0.0 -1 8 {} O 0.0 {0.500717 0.477997 0.382007} O7 7396 0.0 -1 14 {} Si 0.0 {0.518599 0.519105 0.332922} Si8 7397 0.0 -1 7 {} N 0.0 {0.507123 0.508584 0.333782} N2 7398 0.0 -1 14 {} Si 0.0 {0.505236 0.502686 0.318874} Si9 7399 0.0 -1 14 {} Si 0.0 {0.507011 0.508124 0.35333} Si10 7400 0.0 -1 6 {} C 0.0 {0.567849 0.478719 0.39949} C3 7401 0.0 -1 7 {} N 0.0 {0.510629 0.450749 0.402284} N 7402 0.0 -1 8 {} O 0.0 {0.526939 0.472251 0.412255} O8 7403 0.0 -1 8 {} O 0.0 {0.556102 0.452317 0.409678} O9 7404 0.0 -1 8 {} O 0.0 {0.557806 0.476198 0.384808} O10 7405 0.0 -1 1 {} H 0.0 {0.513544 0.534989 0.332806} H18 7406 0.0 -1 1 {} H 0.0 {0.535539 0.514949 0.333988} H19 7407 0.0 -1 1 {} H 0.0 {0.492167 0.491841 0.323646} H20 7408 0.0 -1 1 {} H 0.0 {0.498859 0.510898 0.309894} H22 7409 0.0 -1 1 {} H 0.0 {0.504992 0.520305 0.362427} H24 7410 0.0 -1 1 {} H 0.0 {0.51613 0.465179 0.330911} H25 7411 0.0 -1 1 {} H 0.0 {0.577608 0.477131 0.396603} H26 7412 0.0 -1 1 {} H 0.0 {0.566028 0.474085 0.409069} H27 7413 0.0 -1 1 {} H 0.0 {0.565229 0.488638 0.4016} H28 7414 0.0 -1 1 {} H 0.0 {0.504198 0.454388 0.409712} H29 7415 0.0 -1 1 {} H 0.0 {0.515163 0.442785 0.406799} H31 7416 0.0 -1 1 {} H 0.0 {0.520593 0.480135 0.412978} H32 7417 0.0 -1 1 {} H 0.0 {0.556629 0.442744 0.407959} H33 7418 0.0 -1 1 {} H 0.0 {0.550627 0.483153 0.386675} H34 7419 0.0 -1 7 {} N 0.0 {0.524095 0.495977 0.311944} N3 7420 0.0 -1 1 {} H 0.0 {0.525682 0.50373 0.305876} H16 7421 0.0 -1 1 {} H 0.0 {0.520529 0.489471 0.304512} H17 7422 0.0 -1 7 {} N 0.0 {0.490975 0.497969 0.35666} N6 7423 0.0 -1 1 {} H 0.0 {0.495173 0.489489 0.360294} H41 7424 0.0 -1 1 {} H 0.0 {0.486012 0.502047 0.364049} H42 7425 0.0 -1 14 {} Si 0.0 {0.600004 0.457744 0.368426} Si6 7426 0.0 -1 8 {} O 0.0 {0.591368 0.461998 0.356214} O6 7427 0.0 -1 14 {} Si 0.0 {0.591456 0.458034 0.341112} Si7 7428 0.0 -1 8 {} O 0.0 {0.577967 0.473796 0.327231} O7 7429 0.0 -1 14 {} Si 0.0 {0.589744 0.482235 0.33302} Si8 7430 0.0 -1 7 {} N 0.0 {0.624281 0.57394 0.380466} N2 7431 0.0 -1 14 {} Si 0.0 {0.48679 0.528929 0.207849} Si9 7432 0.0 -1 14 {} Si 0.0 {0.573145 0.491232 0.348573} Si10 7433 0.0 -1 6 {} C 0.0 {0.616157 0.462029 0.370048} C3 7434 0.0 -1 7 {} N 0.0 {0.489058 0.182163 0.420825} N 7435 0.0 -1 8 {} O 0.0 {0.605798 0.462815 0.33719} O8 7436 0.0 -1 8 {} O 0.0 {0.593328 0.438171 0.36941} O9 7437 0.0 -1 8 {} O 0.0 {0.583862 0.462216 0.382743} O10 7438 0.0 -1 1 {} H 0.0 {0.581881 0.470916 0.379718} H18 7439 0.0 -1 1 {} H 0.0 {0.592985 0.491802 0.323302} H19 7440 0.0 -1 1 {} H 0.0 {0.471881 0.535525 0.207181} H20 7441 0.0 -1 1 {} H 0.0 {0.549959 0.481352 0.305681} H22 7442 0.0 -1 1 {} H 0.0 {0.575146 0.479263 0.319075} H24 7443 0.0 -1 1 {} H 0.0 {0.620542 0.493964 0.388758} H25 7444 0.0 -1 1 {} H 0.0 {0.629324 0.437798 0.431586} H26 7445 0.0 -1 1 {} H 0.0 {0.619585 0.460181 0.379792} H27 7446 0.0 -1 1 {} H 0.0 {0.6363 0.423383 0.339915} H28 7447 0.0 -1 1 {} H 0.0 {0.49614 0.174618 0.420391} H29 7448 0.0 -1 1 {} H 0.0 {0.494051 0.190819 0.418817} H31 7449 0.0 -1 1 {} H 0.0 {0.60527 0.47474 0.336422} H32 7450 0.0 -1 1 {} H 0.0 {0.58542 0.43882 0.375576} H33 7451 0.0 -1 1 {} H 0.0 {0.575937 0.456574 0.37983} H34 7452 0.0 -1 7 {} N 0.0 {0.503159 0.534259 0.198564} N3 7453 0.0 -1 1 {} H 0.0 {0.30902 0.428627 0.524464} H16 7454 0.0 -1 1 {} H 0.0 {0.510663 0.529862 0.203522} H17 7455 0.0 -1 7 {} N 0.0 {0.579851 0.488116 0.366992} N6 7456 0.0 -1 1 {} H 0.0 {0.584045 0.478943 0.364148} H41 7457 0.0 -1 1 {} H 0.0 {0.570811 0.486238 0.371504} H42 7458 0.0 -1 14 {} Si 0.0 {0.710865 0.509439 0.513335} Si6 7459 0.0 -1 8 {} O 0.0 {0.706023 0.524872 0.512303} O6 7460 0.0 -1 14 {} Si 0.0 {0.418347 0.346172 0.32561} Si7 7461 0.0 -1 8 {} O 0.0 {0.433601 0.346586 0.330991} O7 7462 0.0 -1 14 {} Si 0.0 {0.44602 0.33713 0.331857} Si8 7463 0.0 -1 7 {} N 0.0 {0.453474 0.334983 0.349191} N2 7464 0.0 -1 14 {} Si 0.0 {0.450445 0.345322 0.361217} Si9 7465 0.0 -1 14 {} Si 0.0 {0.470983 0.342955 0.347374} Si10 7466 0.0 -1 6 {} C 0.0 {0.703743 0.49565 0.505904} C3 7467 0.0 -1 7 {} N 0.0 {0.405627 0.341919 0.335047} N 7468 0.0 -1 8 {} O 0.0 {0.503726 0.34038 0.389374} O8 7469 0.0 -1 8 {} O 0.0 {0.448211 0.303397 0.354134} O9 7470 0.0 -1 8 {} O 0.0 {0.467676 0.197572 0.403032} O10 7471 0.0 -1 1 {} H 0.0 {0.440429 0.322205 0.329201} H18 7472 0.0 -1 1 {} H 0.0 {0.455542 0.339656 0.318536} H19 7473 0.0 -1 1 {} H 0.0 {0.434658 0.345585 0.366679} H20 7474 0.0 -1 1 {} H 0.0 {0.462077 0.321804 0.378228} H22 7475 0.0 -1 1 {} H 0.0 {0.472334 0.338491 0.333371} H24 7476 0.0 -1 1 {} H 0.0 {0.541828 0.361208 0.314891} H25 7477 0.0 -1 1 {} H 0.0 {0.713434 0.483594 0.502602} H26 7478 0.0 -1 1 {} H 0.0 {0.699386 0.499068 0.496547} H27 7479 0.0 -1 1 {} H 0.0 {0.696073 0.490861 0.511163} H28 7480 0.0 -1 1 {} H 0.0 {0.340571 0.539415 0.285432} H29 7481 0.0 -1 1 {} H 0.0 {0.649073 0.502213 0.535758} H31 7482 0.0 -1 1 {} H 0.0 {0.437781 0.298753 0.359722} H32 7483 0.0 -1 1 {} H 0.0 {0.616925 0.617441 0.600351} H33 7484 0.0 -1 1 {} H 0.0 {0.725521 0.50803 0.506607} H34 7485 0.0 -1 7 {} N 0.0 {0.450135 0.361091 0.35598} N3 7486 0.0 -1 1 {} H 0.0 {0.440929 0.365611 0.358453} H16 7487 0.0 -1 1 {} H 0.0 {0.448495 0.360646 0.345696} H17 7488 0.0 -1 7 {} N 0.0 {0.483869 0.332145 0.357514} N6 7489 0.0 -1 1 {} H 0.0 {0.485104 0.33675 0.365983} H41 7490 0.0 -1 1 {} H 0.0 {0.476817 0.325063 0.359978} H42 7491 0.0 -1 14 {} Si 0.0 {0.550661 0.461523 0.511855} Si6 7492 0.0 -1 8 {} O 0.0 {0.551309 0.473883 0.501848} O6 7493 0.0 -1 14 {} Si 0.0 {0.543724 0.484731 0.493098} Si7 7494 0.0 -1 8 {} O 0.0 {0.537598 0.493365 0.504661} O7 7495 0.0 -1 14 {} Si 0.0 {0.534409 0.494879 0.519934} Si8 7496 0.0 -1 7 {} N 0.0 {0.525685 0.484026 0.52889} N2 7497 0.0 -1 14 {} Si 0.0 {0.515812 0.474673 0.519816} Si9 7498 0.0 -1 14 {} Si 0.0 {0.520695 0.479385 0.544376} Si10 7499 0.0 -1 6 {} C 0.0 {0.556172 0.462588 0.529611} C3 7500 0.0 -1 7 {} N 0.0 {0.551619 0.492486 0.479891} N 7501 0.0 -1 8 {} O 0.0 {0.525563 0.474487 0.49123} O8 7502 0.0 -1 8 {} O 0.0 {0.557291 0.452258 0.500199} O9 7503 0.0 -1 8 {} O 0.0 {0.532287 0.45362 0.506819} O10 7504 0.0 -1 1 {} H 0.0 {0.549862 0.498496 0.527634} H18 7505 0.0 -1 1 {} H 0.0 {0.526323 0.510207 0.520759} H19 7506 0.0 -1 1 {} H 0.0 {0.520972 0.476088 0.501782} H20 7507 0.0 -1 1 {} H 0.0 {0.525473 0.461451 0.513276} H22 7508 0.0 -1 1 {} H 0.0 {0.517398 0.462492 0.545479} H24 7509 0.0 -1 1 {} H 0.0 {0.509092 0.487241 0.549184} H25 7510 0.0 -1 1 {} H 0.0 {0.56379 0.455515 0.531732} H26 7511 0.0 -1 1 {} H 0.0 {0.547959 0.461375 0.535941} H27 7512 0.0 -1 1 {} H 0.0 {0.559029 0.472199 0.531669} H28 7513 0.0 -1 1 {} H 0.0 {0.56053 0.497255 0.483203} H29 7514 0.0 -1 1 {} H 0.0 {0.545755 0.500732 0.476237} H31 7515 0.0 -1 1 {} H 0.0 {0.522162 0.481306 0.48543} H32 7516 0.0 -1 1 {} H 0.0 {0.566467 0.455665 0.499264} H33 7517 0.0 -1 1 {} H 0.0 {0.532345 0.456669 0.497672} H34 7518 0.0 -1 7 {} N 0.0 {0.500401 0.485384 0.511711} N3 7519 0.0 -1 1 {} H 0.0 {0.504879 0.490552 0.504079} H16 7520 0.0 -1 1 {} H 0.0 {0.493757 0.478258 0.508236} H17 7521 0.0 -1 7 {} N 0.0 {0.535709 0.480251 0.557628} N6 7522 0.0 -1 1 {} H 0.0 {0.537999 0.471577 0.562019} H41 7523 0.0 -1 1 {} H 0.0 {0.543553 0.484123 0.553265} H42 7524 0.0 -1 14 {} Si 0.0 {0.509414 0.670915 0.573801} Si6 7525 0.0 -1 8 {} O 0.0 {0.514816 0.685515 0.573284} O6 7526 0.0 -1 14 {} Si 0.0 {0.516216 0.698916 0.565919} Si7 7527 0.0 -1 8 {} O 0.0 {0.508443 0.708673 0.57494} O7 7528 0.0 -1 14 {} Si 0.0 {0.455256 0.696447 0.558281} Si8 7529 0.0 -1 7 {} N 0.0 {0.463661 0.702171 0.545462} N2 7530 0.0 -1 14 {} Si 0.0 {0.46259 0.700799 0.603727} Si9 7531 0.0 -1 14 {} Si 0.0 {0.493887 0.715467 0.575607} Si10 7532 0.0 -1 6 {} C 0.0 {0.513185 0.657621 0.561296} C3 7533 0.0 -1 7 {} N 0.0 {0.529437 0.707801 0.553117} N 7534 0.0 -1 8 {} O 0.0 {0.482624 0.697862 0.54581} O8 7535 0.0 -1 8 {} O 0.0 {0.495112 0.673933 0.579099} O9 7536 0.0 -1 8 {} O 0.0 {0.5186 0.670813 0.593347} O10 7537 0.0 -1 1 {} H 0.0 {0.464681 0.695852 0.569846} H18 7538 0.0 -1 1 {} H 0.0 {0.445268 0.704975 0.562933} H19 7539 0.0 -1 1 {} H 0.0 {0.454235 0.690813 0.604733} H20 7540 0.0 -1 1 {} H 0.0 {0.46799 0.698047 0.59119} H22 7541 0.0 -1 1 {} H 0.0 {0.489898 0.721615 0.561605} H24 7542 0.0 -1 1 {} H 0.0 {0.49578 0.721451 0.61949} H25 7543 0.0 -1 1 {} H 0.0 {0.52072 0.651427 0.564769} H26 7544 0.0 -1 1 {} H 0.0 {0.515031 0.662285 0.552467} H27 7545 0.0 -1 1 {} H 0.0 {0.503902 0.652133 0.560473} H28 7546 0.0 -1 1 {} H 0.0 {0.536962 0.700502 0.551268} H29 7547 0.0 -1 1 {} H 0.0 {0.533932 0.714609 0.559202} H31 7548 0.0 -1 1 {} H 0.0 {0.483633 0.689617 0.541} H32 7549 0.0 -1 1 {} H 0.0 {0.496175 0.672599 0.589504} H33 7550 0.0 -1 1 {} H 0.0 {0.52193 0.680198 0.593333} H34 7551 0.0 -1 7 {} N 0.0 {0.454772 0.717601 0.608366} N3 7552 0.0 -1 1 {} H 0.0 {0.446469 0.717659 0.603097} H16 7553 0.0 -1 1 {} H 0.0 {0.461152 0.72377 0.603144} H17 7554 0.0 -1 7 {} N 0.0 {0.270009 0.459772 0.432486} N6 7555 0.0 -1 1 {} H 0.0 {0.277113 0.458327 0.439733} H41 7556 0.0 -1 1 {} H 0.0 {0.264961 0.451163 0.43196} H42 7557 0.0 -1 14 {} Si 0.0 {0.510423 0.759959 0.574564} Si6 7558 0.0 -1 8 {} O 0.0 {0.50424 0.763038 0.601354} O6 7559 0.0 -1 14 {} Si 0.0 {0.256666 0.554408 0.635976} Si7 7560 0.0 -1 8 {} O 0.0 {0.640114 0.370298 0.796666} O7 7561 0.0 -1 14 {} Si 0.0 {0.639531 0.370785 0.780822} Si8 7562 0.0 -1 7 {} N 0.0 {0.643934 0.383515 0.770894} N2 7563 0.0 -1 14 {} Si 0.0 {0.658168 0.386637 0.76366} Si9 7564 0.0 -1 14 {} Si 0.0 {0.637376 0.397867 0.766862} Si10 7565 0.0 -1 6 {} C 0.0 {0.517064 0.761679 0.589249} C3 7566 0.0 -1 7 {} N 0.0 {0.268773 0.544855 0.640228} N 7567 0.0 -1 8 {} O 0.0 {0.568635 0.684309 0.391303} O8 7568 0.0 -1 8 {} O 0.0 {0.51541 0.752697 0.561208} O9 7569 0.0 -1 8 {} O 0.0 {0.4902 0.752172 0.572343} O10 7570 0.0 -1 1 {} H 0.0 {0.627664 0.34964 0.773469} H18 7571 0.0 -1 1 {} H 0.0 {0.607849 0.510157 0.651602} H19 7572 0.0 -1 1 {} H 0.0 {0.606485 0.396964 0.680506} H20 7573 0.0 -1 1 {} H 0.0 {0.443499 0.276753 0.354051} H22 7574 0.0 -1 1 {} H 0.0 {0.630893 0.396895 0.751023} H24 7575 0.0 -1 1 {} H 0.0 {0.668044 0.394547 0.771449} H25 7576 0.0 -1 1 {} H 0.0 {0.521695 0.726496 0.576256} H26 7577 0.0 -1 1 {} H 0.0 {0.525621 0.768118 0.588852} H27 7578 0.0 -1 1 {} H 0.0 {0.275148 0.448605 0.534227} H28 7579 0.0 -1 1 {} H 0.0 {0.45348 0.205552 0.574163} H29 7580 0.0 -1 1 {} H 0.0 {0.267066 0.53676 0.646001} H31 7581 0.0 -1 1 {} H 0.0 {0.568563 0.674781 0.384428} H32 7582 0.0 -1 1 {} H 0.0 {0.274974 0.460918 0.423323} H33 7583 0.0 -1 1 {} H 0.0 {0.488425 0.746667 0.580314} H34 7584 0.0 -1 7 {} N 0.0 {0.662334 0.376743 0.748102} N3 7585 0.0 -1 1 {} H 0.0 {0.653041 0.373581 0.745238} H16 7586 0.0 -1 1 {} H 0.0 {0.66451 0.383585 0.740883} H17 7587 0.0 -1 7 {} N 0.0 {0.639089 0.414775 0.777406} N6 7588 0.0 -1 1 {} H 0.0 {0.450593 0.278319 0.355957} H41 7589 0.0 -1 1 {} H 0.0 {0.650063 0.369185 0.798842} H42 7590 0.0 -1 14 {} Si 0.0 {0.577068 0.299168 0.414442} Si6 7591 0.0 -1 8 {} O 0.0 {0.567114 0.293379 0.425219} O6 7592 0.0 -1 14 {} Si 0.0 {0.56425 0.287437 0.439578} Si7 7593 0.0 -1 8 {} O 0.0 {0.558606 0.301042 0.446108} O7 7594 0.0 -1 14 {} Si 0.0 {0.549917 0.313943 0.446881} Si8 7595 0.0 -1 7 {} N 0.0 {0.537966 0.320717 0.431774} N2 7596 0.0 -1 14 {} Si 0.0 {0.5412 0.308225 0.422023} Si9 7597 0.0 -1 14 {} Si 0.0 {0.529264 0.330848 0.422299} Si10 7598 0.0 -1 6 {} C 0.0 {0.596391 0.299028 0.416027} C3 7599 0.0 -1 7 {} N 0.0 {0.550623 0.273584 0.440539} N 7600 0.0 -1 8 {} O 0.0 {0.578796 0.285229 0.446879} O8 7601 0.0 -1 8 {} O 0.0 {0.570142 0.33969 0.411943} O9 7602 0.0 -1 8 {} O 0.0 {0.564428 0.312513 0.406293} O10 7603 0.0 -1 1 {} H 0.0 {0.541434 0.310812 0.459771} H18 7604 0.0 -1 1 {} H 0.0 {0.561524 0.32501 0.451031} H19 7605 0.0 -1 1 {} H 0.0 {0.575013 0.340829 0.384368} H20 7606 0.0 -1 1 {} H 0.0 {0.554257 0.309801 0.412594} H22 7607 0.0 -1 1 {} H 0.0 {0.514891 0.328002 0.422697} H24 7608 0.0 -1 1 {} H 0.0 {0.530505 0.324132 0.404933} H25 7609 0.0 -1 1 {} H 0.0 {0.598682 0.297375 0.4062} H26 7610 0.0 -1 1 {} H 0.0 {0.200798 0.500577 0.50864} H27 7611 0.0 -1 1 {} H 0.0 {0.598999 0.308175 0.420376} H28 7612 0.0 -1 1 {} H 0.0 {0.542445 0.277111 0.435175} H29 7613 0.0 -1 1 {} H 0.0 {0.547799 0.274647 0.450145} H31 7614 0.0 -1 1 {} H 0.0 {0.579216 0.275502 0.449659} H32 7615 0.0 -1 1 {} H 0.0 {0.566419 0.339427 0.402719} H33 7616 0.0 -1 1 {} H 0.0 {0.567381 0.320618 0.411197} H34 7617 0.0 -1 7 {} N 0.0 {0.528845 0.293748 0.417404} N3 7618 0.0 -1 1 {} H 0.0 {0.521979 0.299126 0.411681} H16 7619 0.0 -1 1 {} H 0.0 {0.523799 0.291763 0.426204} H17 7620 0.0 -1 7 {} N 0.0 {0.535793 0.347964 0.425115} N6 7621 0.0 -1 1 {} H 0.0 {0.545696 0.348863 0.423113} H41 7622 0.0 -1 1 {} H 0.0 {0.530953 0.353445 0.418275} H42 7623 0.0 -1 14 {} Si 0.0 {0.614233 0.373831 0.787004} Si6 7624 0.0 -1 8 {} O 0.0 {0.610303 0.368486 0.772941} O6 7625 0.0 -1 14 {} Si 0.0 {0.603872 0.35693 0.763593} Si7 7626 0.0 -1 8 {} O 0.0 {0.594944 0.366026 0.753494} O7 7627 0.0 -1 14 {} Si 0.0 {0.580151 0.365234 0.776115} Si8 7628 0.0 -1 7 {} N 0.0 {0.565052 0.364388 0.771343} N2 7629 0.0 -1 14 {} Si 0.0 {0.549682 0.361004 0.768991} Si9 7630 0.0 -1 14 {} Si 0.0 {0.536744 0.381149 0.754776} Si10 7631 0.0 -1 6 {} C 0.0 {0.609789 0.365252 0.803009} C3 7632 0.0 -1 7 {} N 0.0 {0.610276 0.338642 0.76425} N 7633 0.0 -1 8 {} O 0.0 {0.583451 0.33434 0.779027} O8 7634 0.0 -1 8 {} O 0.0 {0.61538 0.389305 0.784369} O9 7635 0.0 -1 8 {} O 0.0 {0.635864 0.35398 0.76935} O10 7636 0.0 -1 1 {} H 0.0 {0.582961 0.349253 0.779174} H18 7637 0.0 -1 1 {} H 0.0 {0.583076 0.378083 0.786353} H19 7638 0.0 -1 1 {} H 0.0 {0.542801 0.371488 0.762017} H20 7639 0.0 -1 1 {} H 0.0 {0.542428 0.346654 0.76131} H22 7640 0.0 -1 1 {} H 0.0 {0.520286 0.3794 0.754077} H24 7641 0.0 -1 1 {} H 0.0 {0.608006 0.356069 0.389133} H25 7642 0.0 -1 1 {} H 0.0 {0.608744 0.354917 0.80118} H26 7643 0.0 -1 1 {} H 0.0 {0.600314 0.368808 0.806782} H27 7644 0.0 -1 1 {} H 0.0 {0.618159 0.36716 0.809545} H28 7645 0.0 -1 1 {} H 0.0 {0.606157 0.335455 0.754965} H29 7646 0.0 -1 1 {} H 0.0 {0.620284 0.339815 0.76173} H31 7647 0.0 -1 1 {} H 0.0 {0.593236 0.334018 0.77819} H32 7648 0.0 -1 1 {} H 0.0 {0.625035 0.391025 0.778473} H33 7649 0.0 -1 1 {} H 0.0 {0.666534 0.304884 0.542369} H34 7650 0.0 -1 7 {} N 0.0 {0.54251 0.360315 0.786489} N3 7651 0.0 -1 1 {} H 0.0 {0.542633 0.350916 0.788906} H16 7652 0.0 -1 1 {} H 0.0 {0.54937 0.365439 0.792429} H17 7653 0.0 -1 7 {} N 0.0 {0.54237 0.383323 0.739973} N6 7654 0.0 -1 1 {} H 0.0 {0.540044 0.377007 0.733052} H41 7655 0.0 -1 1 {} H 0.0 {0.319034 0.60807 0.603691} H42 7656 0.0 -1 14 {} Si 0.0 {0.522155 0.458081 0.698285} Si6 7657 0.0 -1 8 {} O 0.0 {0.515901 0.452126 0.711908} O6 7658 0.0 -1 14 {} Si 0.0 {0.436221 0.486944 0.767963} Si7 7659 0.0 -1 8 {} O 0.0 {0.450144 0.479595 0.772781} O7 7660 0.0 -1 14 {} Si 0.0 {0.464947 0.475119 0.770592} Si8 7661 0.0 -1 7 {} N 0.0 {0.469208 0.460398 0.75768} N2 7662 0.0 -1 14 {} Si 0.0 {0.454225 0.456054 0.753968} Si9 7663 0.0 -1 14 {} Si 0.0 {0.688252 0.405993 0.373019} Si10 7664 0.0 -1 6 {} C 0.0 {0.540595 0.458149 0.695522} C3 7665 0.0 -1 7 {} N 0.0 {0.41923 0.477759 0.76652} N 7666 0.0 -1 8 {} O 0.0 {0.437058 0.496254 0.780991} O8 7667 0.0 -1 8 {} O 0.0 {0.492722 0.442708 0.657762} O9 7668 0.0 -1 8 {} O 0.0 {0.513111 0.471407 0.698331} O10 7669 0.0 -1 1 {} H 0.0 {0.622404 0.434337 0.767708} H18 7670 0.0 -1 1 {} H 0.0 {0.479204 0.480452 0.788828} H19 7671 0.0 -1 1 {} H 0.0 {0.446182 0.460435 0.763593} H20 7672 0.0 -1 1 {} H 0.0 {0.447606 0.460445 0.73909} H22 7673 0.0 -1 1 {} H 0.0 {0.696791 0.420669 0.375492} H24 7674 0.0 -1 1 {} H 0.0 {0.687585 0.402829 0.386127} H25 7675 0.0 -1 1 {} H 0.0 {0.543641 0.447891 0.696619} H26 7676 0.0 -1 1 {} H 0.0 {0.546483 0.464501 0.701631} H27 7677 0.0 -1 1 {} H 0.0 {0.542457 0.46325 0.685768} H28 7678 0.0 -1 1 {} H 0.0 {0.41948 0.470734 0.773691} H29 7679 0.0 -1 1 {} H 0.0 {0.412396 0.484208 0.770223} H31 7680 0.0 -1 1 {} H 0.0 {0.441942 0.504097 0.779773} H32 7681 0.0 -1 1 {} H 0.0 {0.500325 0.437306 0.661902} H33 7682 0.0 -1 1 {} H 0.0 {0.503805 0.469252 0.69829} H34 7683 0.0 -1 7 {} N 0.0 {0.449619 0.436341 0.756284} N3 7684 0.0 -1 1 {} H 0.0 {0.439022 0.41195 0.750688} H16 7685 0.0 -1 1 {} H 0.0 {0.442723 0.432154 0.762834} H17 7686 0.0 -1 7 {} N 0.0 {0.701245 0.398023 0.363827} N6 7687 0.0 -1 1 {} H 0.0 {0.70949 0.403834 0.364009} H41 7688 0.0 -1 1 {} H 0.0 {0.702588 0.389949 0.369626} H42 7689 0.0 -1 14 {} Si 0.0 {0.242144 0.329582 0.604112} Si6 7690 0.0 -1 8 {} O 0.0 {0.246741 0.339329 0.584372} O6 7691 0.0 -1 14 {} Si 0.0 {0.267527 0.32577 0.60113} Si7 7692 0.0 -1 8 {} O 0.0 {0.439361 0.371164 0.29897} O7 7693 0.0 -1 14 {} Si 0.0 {0.302512 0.294661 0.62943} Si8 7694 0.0 -1 7 {} N 0.0 {0.539021 0.363379 0.324067} N2 7695 0.0 -1 14 {} Si 0.0 {0.521449 0.355833 0.324095} Si9 7696 0.0 -1 14 {} Si 0.0 {0.545514 0.35088 0.332887} Si10 7697 0.0 -1 6 {} C 0.0 {0.277192 0.336717 0.610582} C3 7698 0.0 -1 7 {} N 0.0 {0.289812 0.297668 0.618897} N 7699 0.0 -1 8 {} O 0.0 {0.266848 0.310086 0.600727} O8 7700 0.0 -1 8 {} O 0.0 {0.245301 0.330805 0.624352} O9 7701 0.0 -1 8 {} O 0.0 {0.239138 0.31466 0.600323} O10 7702 0.0 -1 1 {} H 0.0 {0.30316 0.304892 0.63811} H18 7703 0.0 -1 1 {} H 0.0 {0.298459 0.28292 0.637846} H19 7704 0.0 -1 1 {} H 0.0 {0.516513 0.346104 0.334407} H20 7705 0.0 -1 1 {} H 0.0 {0.511371 0.365688 0.322544} H22 7706 0.0 -1 1 {} H 0.0 {0.559218 0.35515 0.336589} H24 7707 0.0 -1 1 {} H 0.0 {0.544696 0.336524 0.326672} H25 7708 0.0 -1 1 {} H 0.0 {0.278837 0.332054 0.620006} H26 7709 0.0 -1 1 {} H 0.0 {0.247861 0.30986 0.600258} H27 7710 0.0 -1 1 {} H 0.0 {0.286789 0.337455 0.606359} H28 7711 0.0 -1 1 {} H 0.0 {0.275069 0.396502 0.551754} H29 7712 0.0 -1 1 {} H 0.0 {0.281716 0.291905 0.622528} H31 7713 0.0 -1 1 {} H 0.0 {0.273826 0.306017 0.605969} H32 7714 0.0 -1 1 {} H 0.0 {0.25316 0.337115 0.625229} H33 7715 0.0 -1 1 {} H 0.0 {0.569429 0.686543 0.285316} H34 7716 0.0 -1 7 {} N 0.0 {0.518177 0.34592 0.307955} N3 7717 0.0 -1 1 {} H 0.0 {0.527044 0.34134 0.305793} H16 7718 0.0 -1 1 {} H 0.0 {0.512339 0.337964 0.310464} H17 7719 0.0 -1 7 {} N 0.0 {0.541486 0.561368 0.753166} N6 7720 0.0 -1 1 {} H 0.0 {0.532017 0.565137 0.753273} H41 7721 0.0 -1 1 {} H 0.0 {0.539297 0.551942 0.75529} H42 7722 0.0 -1 14 {} Si 0.0 {0.746976 0.48662 0.450544} Si6 7723 0.0 -1 8 {} O 0.0 {0.710209 0.459198 0.471613} O6 7724 0.0 -1 14 {} Si 0.0 {0.699402 0.448735 0.468041} Si7 7725 0.0 -1 8 {} O 0.0 {0.687573 0.454195 0.480036} O7 7726 0.0 -1 14 {} Si 0.0 {0.724668 0.46507 0.471535} Si8 7727 0.0 -1 7 {} N 0.0 {0.749683 0.48766 0.522308} N2 7728 0.0 -1 14 {} Si 0.0 {0.722421 0.447418 0.510595} Si9 7729 0.0 -1 14 {} Si 0.0 {0.750364 0.477226 0.533998} Si10 7730 0.0 -1 6 {} C 0.0 {0.732078 0.481987 0.457791} C3 7731 0.0 -1 7 {} N 0.0 {0.691688 0.444561 0.451395} N 7732 0.0 -1 8 {} O 0.0 {0.706366 0.435978 0.474537} O8 7733 0.0 -1 8 {} O 0.0 {0.749147 0.502122 0.388334} O9 7734 0.0 -1 8 {} O 0.0 {0.738055 0.467729 0.448622} O10 7735 0.0 -1 1 {} H 0.0 {0.551208 0.657465 0.456902} H18 7736 0.0 -1 1 {} H 0.0 {0.745843 0.47797 0.473787} H19 7737 0.0 -1 1 {} H 0.0 {0.726022 0.46853 0.485665} H20 7738 0.0 -1 1 {} H 0.0 {0.723897 0.459331 0.504269} H22 7739 0.0 -1 1 {} H 0.0 {0.764228 0.46708 0.536103} H24 7740 0.0 -1 1 {} H 0.0 {0.738931 0.465451 0.535138} H25 7741 0.0 -1 1 {} H 0.0 {0.554158 0.66102 0.462984} H26 7742 0.0 -1 1 {} H 0.0 {0.614039 0.215882 0.514428} H27 7743 0.0 -1 1 {} H 0.0 {0.724568 0.488978 0.454799} H28 7744 0.0 -1 1 {} H 0.0 {0.698889 0.448357 0.445801} H29 7745 0.0 -1 1 {} H 0.0 {0.6846 0.451951 0.45132} H31 7746 0.0 -1 1 {} H 0.0 {0.70585 0.427281 0.468952} H32 7747 0.0 -1 1 {} H 0.0 {0.747184 0.511295 0.392517} H33 7748 0.0 -1 1 {} H 0.0 {0.420596 0.467786 0.713427} H34 7749 0.0 -1 7 {} N 0.0 {0.722521 0.409613 0.499369} N3 7750 0.0 -1 1 {} H 0.0 {0.730811 0.404282 0.501432} H16 7751 0.0 -1 1 {} H 0.0 {0.719602 0.406222 0.489839} H17 7752 0.0 -1 7 {} N 0.0 {0.744736 0.48629 0.549829} N6 7753 0.0 -1 1 {} H 0.0 {0.735013 0.48592 0.548358} H41 7754 0.0 -1 1 {} H 0.0 {0.747772 0.495218 0.545561} H42 7755 0.0 -1 14 {} Si 0.0 {0.320781 0.64369 0.519208} Si6 7756 0.0 -1 8 {} O 0.0 {0.337127 0.630832 0.516436} O6 7757 0.0 -1 14 {} Si 0.0 {0.428596 0.246033 0.591161} Si7 7758 0.0 -1 8 {} O 0.0 {0.432749 0.260899 0.595639} O7 7759 0.0 -1 14 {} Si 0.0 {0.434624 0.237277 0.612406} Si8 7760 0.0 -1 7 {} N 0.0 {0.440852 0.244651 0.624683} N2 7761 0.0 -1 14 {} Si 0.0 {0.41022 0.266169 0.631195} Si9 7762 0.0 -1 14 {} Si 0.0 {0.436683 0.26021 0.624911} Si10 7763 0.0 -1 6 {} C 0.0 {0.305063 0.638509 0.525803} C3 7764 0.0 -1 7 {} N 0.0 {0.413452 0.243233 0.584041} N 7765 0.0 -1 8 {} O 0.0 {0.441267 0.239148 0.585371} O8 7766 0.0 -1 8 {} O 0.0 {0.321775 0.649338 0.503628} O9 7767 0.0 -1 8 {} O 0.0 {0.33008 0.656334 0.521983} O10 7768 0.0 -1 1 {} H 0.0 {0.420822 0.229572 0.618457} H18 7769 0.0 -1 1 {} H 0.0 {0.427572 0.266796 0.590091} H19 7770 0.0 -1 1 {} H 0.0 {0.405861 0.244634 0.623655} H20 7771 0.0 -1 1 {} H 0.0 {0.764052 0.922437 0.511949} H22 7772 0.0 -1 1 {} H 0.0 {0.432193 0.269567 0.654716} H24 7773 0.0 -1 1 {} H 0.0 {0.422168 0.263135 0.628514} H25 7774 0.0 -1 1 {} H 0.0 {0.306164 0.631013 0.53273} H26 7775 0.0 -1 1 {} H 0.0 {0.442813 0.225573 0.608273} H27 7776 0.0 -1 1 {} H 0.0 {0.300416 0.648159 0.528613} H28 7777 0.0 -1 1 {} H 0.0 {0.409469 0.252193 0.581295} H29 7778 0.0 -1 1 {} H 0.0 {0.406084 0.236851 0.587585} H31 7779 0.0 -1 1 {} H 0.0 {0.437641 0.233741 0.577583} H32 7780 0.0 -1 1 {} H 0.0 {0.328595 0.645465 0.498563} H33 7781 0.0 -1 1 {} H 0.0 {0.324575 0.664055 0.522921} H34 7782 0.0 -1 7 {} N 0.0 {0.411076 0.267098 0.650653} N3 7783 0.0 -1 1 {} H 0.0 {0.408049 0.275639 0.653924} H16 7784 0.0 -1 1 {} H 0.0 {0.40391 0.259927 0.653211} H17 7785 0.0 -1 7 {} N 0.0 {0.336191 0.55271 0.614077} N6 7786 0.0 -1 1 {} H 0.0 {0.345015 0.557514 0.613296} H41 7787 0.0 -1 1 {} H 0.0 {0.762362 0.928237 0.507309} H42 7788 0.0 -1 14 {} Si 0.0 {0.393725 0.306668 0.558474} Si6 7789 0.0 -1 8 {} O 0.0 {0.393657 0.312957 0.57289} O6 7790 0.0 -1 14 {} Si 0.0 {0.388932 0.32227 0.584659} Si7 7791 0.0 -1 8 {} O 0.0 {0.393974 0.335828 0.578598} O7 7792 0.0 -1 14 {} Si 0.0 {0.405901 0.345974 0.575555} Si8 7793 0.0 -1 7 {} N 0.0 {0.411094 0.357692 0.586178} N2 7794 0.0 -1 14 {} Si 0.0 {0.429251 0.366389 0.584502} Si9 7795 0.0 -1 14 {} Si 0.0 {0.404128 0.362991 0.600949} Si10 7796 0.0 -1 6 {} C 0.0 {0.390163 0.288629 0.555441} C3 7797 0.0 -1 7 {} N 0.0 {0.418348 0.402688 0.59333} N 7798 0.0 -1 8 {} O 0.0 {0.397015 0.325045 0.604554} O8 7799 0.0 -1 8 {} O 0.0 {0.408196 0.313422 0.555113} O9 7800 0.0 -1 8 {} O 0.0 {0.383338 0.321807 0.54968} O10 7801 0.0 -1 1 {} H 0.0 {0.471784 0.322728 0.587308} H18 7802 0.0 -1 1 {} H 0.0 {0.41234 0.369001 0.529364} H19 7803 0.0 -1 1 {} H 0.0 {0.429221 0.378031 0.592347} H20 7804 0.0 -1 1 {} H 0.0 {0.440367 0.355209 0.585908} H22 7805 0.0 -1 1 {} H 0.0 {0.404483 0.353141 0.612741} H24 7806 0.0 -1 1 {} H 0.0 {0.390283 0.364294 0.599049} H25 7807 0.0 -1 1 {} H 0.0 {0.39846 0.285063 0.550406} H26 7808 0.0 -1 1 {} H 0.0 {0.381346 0.288521 0.549393} H27 7809 0.0 -1 1 {} H 0.0 {0.388931 0.284206 0.564927} H28 7810 0.0 -1 1 {} H 0.0 {0.365089 0.315931 0.516428} H29 7811 0.0 -1 1 {} H 0.0 {0.372512 0.466514 0.603818} H31 7812 0.0 -1 1 {} H 0.0 {0.392873 0.317921 0.609825} H32 7813 0.0 -1 1 {} H 0.0 {0.406113 0.323516 0.553602} H33 7814 0.0 -1 1 {} H 0.0 {0.382998 0.329096 0.556632} H34 7815 0.0 -1 7 {} N 0.0 {0.401971 0.423255 0.54821} N3 7816 0.0 -1 1 {} H 0.0 {0.393244 0.418091 0.52369} H16 7817 0.0 -1 1 {} H 0.0 {0.405292 0.433369 0.547844} H17 7818 0.0 -1 7 {} N 0.0 {0.421713 0.372518 0.622614} N6 7819 0.0 -1 1 {} H 0.0 {0.429014 0.36532 0.620739} H41 7820 0.0 -1 1 {} H 0.0 {0.416018 0.36852 0.629899} H42 7821 0.0 -1 14 {} Si 0.0 {0.475949 0.472934 0.455948} Si6 7822 0.0 -1 8 {} O 0.0 {0.463538 0.441429 0.476465} O6 7823 0.0 -1 14 {} Si 0.0 {0.452785 0.443914 0.487183} Si7 7824 0.0 -1 8 {} O 0.0 {0.440068 0.441447 0.477316} O7 7825 0.0 -1 14 {} Si 0.0 {0.425262 0.444503 0.472899} Si8 7826 0.0 -1 7 {} N 0.0 {0.417063 0.462031 0.469712} N2 7827 0.0 -1 14 {} Si 0.0 {0.425798 0.474625 0.474085} Si9 7828 0.0 -1 14 {} Si 0.0 {0.401312 0.466067 0.468467} Si10 7829 0.0 -1 6 {} C 0.0 {0.474147 0.482712 0.434046} C3 7830 0.0 -1 7 {} N 0.0 {0.455823 0.439074 0.503621} N 7831 0.0 -1 8 {} O 0.0 {0.452042 0.464389 0.486976} O8 7832 0.0 -1 8 {} O 0.0 {0.498961 0.457785 0.428918} O9 7833 0.0 -1 8 {} O 0.0 {0.463792 0.469303 0.431516} O10 7834 0.0 -1 1 {} H 0.0 {0.42298 0.410295 0.438373} H18 7835 0.0 -1 1 {} H 0.0 {0.416911 0.43747 0.483696} H19 7836 0.0 -1 1 {} H 0.0 {0.441822 0.467329 0.480634} H20 7837 0.0 -1 1 {} H 0.0 {0.429422 0.483988 0.461124} H22 7838 0.0 -1 1 {} H 0.0 {0.397258 0.463821 0.451802} H24 7839 0.0 -1 1 {} H 0.0 {0.398715 0.48097 0.470039} H25 7840 0.0 -1 1 {} H 0.0 {0.468265 0.491279 0.43544} H26 7841 0.0 -1 1 {} H 0.0 {0.479803 0.483422 0.424599} H27 7842 0.0 -1 1 {} H 0.0 {0.483857 0.482587 0.438456} H28 7843 0.0 -1 1 {} H 0.0 {0.461705 0.43071 0.505424} H29 7844 0.0 -1 1 {} H 0.0 {0.460226 0.446347 0.509338} H31 7845 0.0 -1 1 {} H 0.0 {0.458901 0.465277 0.479674} H32 7846 0.0 -1 1 {} H 0.0 {0.490391 0.454216 0.427709} H33 7847 0.0 -1 1 {} H 0.0 {0.469555 0.464737 0.424656} H34 7848 0.0 -1 7 {} N 0.0 {0.419906 0.487126 0.488045} N3 7849 0.0 -1 1 {} H 0.0 {0.411961 0.49104 0.483282} H16 7850 0.0 -1 1 {} H 0.0 {0.415396 0.481203 0.495245} H17 7851 0.0 -1 7 {} N 0.0 {0.390932 0.455236 0.481572} N6 7852 0.0 -1 1 {} H 0.0 {0.396445 0.457256 0.490522} H41 7853 0.0 -1 1 {} H 0.0 {0.392811 0.445989 0.478679} H42 7854 0.0 -1 14 {} Si 0.0 {0.30346 0.623143 0.483787} Si6 7855 0.0 -1 8 {} O 0.0 {0.292479 0.627617 0.495207} O6 7856 0.0 -1 14 {} Si 0.0 {0.223311 0.64154 0.513496} Si7 7857 0.0 -1 8 {} O 0.0 {0.222719 0.629832 0.523711} O7 7858 0.0 -1 14 {} Si 0.0 {0.220772 0.625105 0.538284} Si8 7859 0.0 -1 7 {} N 0.0 {0.205304 0.612613 0.540391} N2 7860 0.0 -1 14 {} Si 0.0 {0.206029 0.599375 0.531482} Si9 7861 0.0 -1 14 {} Si 0.0 {0.192603 0.60906 0.550181} Si10 7862 0.0 -1 6 {} C 0.0 {0.311964 0.63436 0.473861} C3 7863 0.0 -1 7 {} N 0.0 {0.607225 0.504074 0.344283} N 7864 0.0 -1 8 {} O 0.0 {0.209577 0.607074 0.452528} O8 7865 0.0 -1 8 {} O 0.0 {0.289872 0.607144 0.476249} O9 7866 0.0 -1 8 {} O 0.0 {0.328834 0.633565 0.479633} O10 7867 0.0 -1 1 {} H 0.0 {0.683078 0.599237 0.295602} H18 7868 0.0 -1 1 {} H 0.0 {0.624147 0.638194 0.508869} H19 7869 0.0 -1 1 {} H 0.0 {0.211355 0.588357 0.538096} H20 7870 0.0 -1 1 {} H 0.0 {0.358937 0.580983 0.350523} H22 7871 0.0 -1 1 {} H 0.0 {0.19594 0.600713 0.564841} H24 7872 0.0 -1 1 {} H 0.0 {0.181515 0.600756 0.544364} H25 7873 0.0 -1 1 {} H 0.0 {0.308527 0.64456 0.474528} H26 7874 0.0 -1 1 {} H 0.0 {0.234658 0.6532 0.515715} H27 7875 0.0 -1 1 {} H 0.0 {0.311558 0.631071 0.463701} H28 7876 0.0 -1 1 {} H 0.0 {0.609469 0.513751 0.346872} H29 7877 0.0 -1 1 {} H 0.0 {0.599338 0.501408 0.350639} H31 7878 0.0 -1 1 {} H 0.0 {0.211054 0.616244 0.455383} H32 7879 0.0 -1 1 {} H 0.0 {0.282491 0.610673 0.481568} H33 7880 0.0 -1 1 {} H 0.0 {0.333286 0.638414 0.472738} H34 7881 0.0 -1 7 {} N 0.0 {0.203836 0.599632 0.511561} N3 7882 0.0 -1 1 {} H 0.0 {0.212749 0.603655 0.5099} H16 7883 0.0 -1 1 {} H 0.0 {0.197246 0.607792 0.510501} H17 7884 0.0 -1 7 {} N 0.0 {0.182597 0.62552 0.555259} N6 7885 0.0 -1 1 {} H 0.0 {0.1907 0.629218 0.560231} H41 7886 0.0 -1 1 {} H 0.0 {0.183504 0.629859 0.546282} H42 7887 0.0 -1 14 {} Si 0.0 {0.304521 0.554641 0.445259} Si6 7888 0.0 -1 8 {} O 0.0 {0.30483 0.544366 0.433055} O6 7889 0.0 -1 14 {} Si 0.0 {0.311387 0.538994 0.419647} Si7 7890 0.0 -1 8 {} O 0.0 {0.296019 0.528419 0.412934} O7 7891 0.0 -1 14 {} Si 0.0 {0.305714 0.514172 0.426129} Si8 7892 0.0 -1 7 {} N 0.0 {0.313236 0.4998 0.419607} N2 7893 0.0 -1 14 {} Si 0.0 {0.32366 0.487478 0.418308} Si9 7894 0.0 -1 14 {} Si 0.0 {0.309603 0.502871 0.404099} Si10 7895 0.0 -1 6 {} C 0.0 {0.319275 0.560997 0.454266} C3 7896 0.0 -1 7 {} N 0.0 {0.31591 0.54867 0.403383} N 7897 0.0 -1 8 {} O 0.0 {0.328876 0.53093 0.427333} O8 7898 0.0 -1 8 {} O 0.0 {0.293169 0.548143 0.454151} O9 7899 0.0 -1 8 {} O 0.0 {0.289976 0.567677 0.438088} O10 7900 0.0 -1 1 {} H 0.0 {0.321626 0.522339 0.432449} H18 7901 0.0 -1 1 {} H 0.0 {0.298032 0.512862 0.438186} H19 7902 0.0 -1 1 {} H 0.0 {0.331995 0.490759 0.407214} H20 7903 0.0 -1 1 {} H 0.0 {0.332352 0.486735 0.432968} H22 7904 0.0 -1 1 {} H 0.0 {0.318675 0.516091 0.395144} H24 7905 0.0 -1 1 {} H 0.0 {0.183474 0.466283 0.600991} H25 7906 0.0 -1 1 {} H 0.0 {0.319379 0.571464 0.453801} H26 7907 0.0 -1 1 {} H 0.0 {0.3278 0.55538 0.451935} H27 7908 0.0 -1 1 {} H 0.0 {0.316052 0.558912 0.46491} H28 7909 0.0 -1 1 {} H 0.0 {0.306613 0.551158 0.400551} H29 7910 0.0 -1 1 {} H 0.0 {0.318201 0.54017 0.397769} H31 7911 0.0 -1 1 {} H 0.0 {0.330278 0.537263 0.435423} H32 7912 0.0 -1 1 {} H 0.0 {0.288286 0.55527 0.459746} H33 7913 0.0 -1 1 {} H 0.0 {0.283715 0.562668 0.432845} H34 7914 0.0 -1 7 {} N 0.0 {0.315387 0.468722 0.411447} N3 7915 0.0 -1 1 {} H 0.0 {0.306064 0.469882 0.408096} H16 7916 0.0 -1 1 {} H 0.0 {0.315005 0.462133 0.420018} H17 7917 0.0 -1 7 {} N 0.0 {0.294215 0.494668 0.396276} N6 7918 0.0 -1 1 {} H 0.0 {0.294381 0.487097 0.402295} H41 7919 0.0 -1 1 {} H 0.0 {0.287257 0.501002 0.399253} H42 7920 0.0 -1 14 {} Si 0.0 {0.4146 0.504876 0.23905} Si6 7921 0.0 -1 8 {} O 0.0 {0.427537 0.508089 0.247276} O6 7922 0.0 -1 14 {} Si 0.0 {0.438845 0.506341 0.257982} Si7 7923 0.0 -1 8 {} O 0.0 {0.431184 0.499103 0.26974} O7 7924 0.0 -1 14 {} Si 0.0 {0.420398 0.497677 0.281265} Si8 7925 0.0 -1 7 {} N 0.0 {0.426857 0.497178 0.299021} N2 7926 0.0 -1 14 {} Si 0.0 {0.441266 0.491767 0.303824} Si9 7927 0.0 -1 14 {} Si 0.0 {0.418718 0.500712 0.315897} Si10 7928 0.0 -1 6 {} C 0.0 {0.407707 0.489769 0.234974} C3 7929 0.0 -1 7 {} N 0.0 {0.456128 0.496755 0.254999} N 7930 0.0 -1 8 {} O 0.0 {0.437153 0.521362 0.26292} O8 7931 0.0 -1 8 {} O 0.0 {0.42117 0.518523 0.225016} O9 7932 0.0 -1 8 {} O 0.0 {0.403445 0.520169 0.247448} O10 7933 0.0 -1 1 {} H 0.0 {0.410539 0.508248 0.279176} H18 7934 0.0 -1 1 {} H 0.0 {0.412595 0.482669 0.277103} H19 7935 0.0 -1 1 {} H 0.0 {0.448736 0.501776 0.308653} H20 7936 0.0 -1 1 {} H 0.0 {0.43998 0.480172 0.313739} H22 7937 0.0 -1 1 {} H 0.0 {0.415707 0.487 0.321562} H24 7938 0.0 -1 1 {} H 0.0 {0.392796 0.482361 0.290879} H25 7939 0.0 -1 1 {} H 0.0 {0.399342 0.491021 0.228674} H26 7940 0.0 -1 1 {} H 0.0 {0.404139 0.48454 0.249486} H27 7941 0.0 -1 1 {} H 0.0 {0.41521 0.484434 0.229732} H28 7942 0.0 -1 1 {} H 0.0 {0.455489 0.49155 0.263808} H29 7943 0.0 -1 1 {} H 0.0 {0.462224 0.505161 0.257403} H31 7944 0.0 -1 1 {} H 0.0 {0.444555 0.526688 0.259933} H32 7945 0.0 -1 1 {} H 0.0 {0.424056 0.526534 0.230705} H33 7946 0.0 -1 1 {} H 0.0 {0.408926 0.527764 0.245011} H34 7947 0.0 -1 7 {} N 0.0 {0.448085 0.484242 0.289374} N3 7948 0.0 -1 1 {} H 0.0 {0.458048 0.486475 0.290718} H16 7949 0.0 -1 1 {} H 0.0 {0.443998 0.489534 0.281746} H17 7950 0.0 -1 7 {} N 0.0 {0.404501 0.51325 0.313126} N6 7951 0.0 -1 1 {} H 0.0 {0.403793 0.513992 0.303065} H41 7952 0.0 -1 1 {} H 0.0 {0.396197 0.507672 0.316008} H42 7953 0.0 -1 14 {} Si 0.0 {0.43904 0.561571 0.605855} Si6 7954 0.0 -1 8 {} O 0.0 {0.467147 0.560519 0.612942} O6 7955 0.0 -1 14 {} Si 0.0 {0.459516 0.553803 0.595602} Si7 7956 0.0 -1 8 {} O 0.0 {0.319909 0.533577 0.542964} O7 7957 0.0 -1 14 {} Si 0.0 {0.327712 0.546149 0.537273} Si8 7958 0.0 -1 7 {} N 0.0 {0.415325 0.535939 0.61437} N2 7959 0.0 -1 14 {} Si 0.0 {0.437884 0.545035 0.525026} Si9 7960 0.0 -1 14 {} Si 0.0 {0.401583 0.532965 0.622854} Si10 7961 0.0 -1 6 {} C 0.0 {0.407585 0.628598 0.433144} C3 7962 0.0 -1 7 {} N 0.0 {0.268938 0.574908 0.666788} N 7963 0.0 -1 8 {} O 0.0 {0.4732 0.548086 0.571327} O8 7964 0.0 -1 8 {} O 0.0 {0.439203 0.556155 0.627793} O9 7965 0.0 -1 8 {} O 0.0 {0.448887 0.54066 0.593302} O10 7966 0.0 -1 1 {} H 0.0 {0.32501 0.521895 0.522785} H18 7967 0.0 -1 1 {} H 0.0 {0.414476 0.599621 0.531115} H19 7968 0.0 -1 1 {} H 0.0 {0.461822 0.538418 0.540157} H20 7969 0.0 -1 1 {} H 0.0 {0.479386 0.504453 0.652074} H22 7970 0.0 -1 1 {} H 0.0 {0.397706 0.520758 0.611398} H24 7971 0.0 -1 1 {} H 0.0 {0.406815 0.5293 0.638235} H25 7972 0.0 -1 1 {} H 0.0 {0.405946 0.621223 0.440556} H26 7973 0.0 -1 1 {} H 0.0 {0.406128 0.624688 0.423516} H27 7974 0.0 -1 1 {} H 0.0 {0.417397 0.632886 0.433324} H28 7975 0.0 -1 1 {} H 0.0 {0.372488 0.548135 0.642926} H29 7976 0.0 -1 1 {} H 0.0 {0.264834 0.580115 0.67448} H31 7977 0.0 -1 1 {} H 0.0 {0.441254 0.534556 0.603793} H32 7978 0.0 -1 1 {} H 0.0 {0.433365 0.548008 0.62779} H33 7979 0.0 -1 1 {} H 0.0 {0.472824 0.471225 0.736141} H34 7980 0.0 -1 7 {} N 0.0 {0.475799 0.512073 0.646019} N3 7981 0.0 -1 1 {} H 0.0 {0.475369 0.519256 0.653455} H16 7982 0.0 -1 1 {} H 0.0 {0.484243 0.514845 0.6399} H17 7983 0.0 -1 7 {} N 0.0 {0.446586 0.616484 0.583478} N6 7984 0.0 -1 1 {} H 0.0 {0.449464 0.61442 0.573909} H41 7985 0.0 -1 1 {} H 0.0 {0.437044 0.620831 0.583884} H42 7986 0.0 -1 14 {} Si 0.0 {0.569836 0.492308 0.665989} Si6 7987 0.0 -1 8 {} O 0.0 {0.573346 0.504548 0.674628} O6 7988 0.0 -1 14 {} Si 0.0 {0.573001 0.520377 0.67587} Si7 7989 0.0 -1 8 {} O 0.0 {0.613576 0.56506 0.65652} O7 7990 0.0 -1 14 {} Si 0.0 {0.606431 0.545803 0.659315} Si8 7991 0.0 -1 7 {} N 0.0 {0.606544 0.50816 0.673572} N2 7992 0.0 -1 14 {} Si 0.0 {0.621644 0.614671 0.578458} Si9 7993 0.0 -1 14 {} Si 0.0 {0.595113 0.51787 0.686089} Si10 7994 0.0 -1 6 {} C 0.0 {0.581413 0.484666 0.65684} C3 7995 0.0 -1 7 {} N 0.0 {0.566725 0.534782 0.66521} N 7996 0.0 -1 8 {} O 0.0 {0.567902 0.522389 0.69064} O8 7997 0.0 -1 8 {} O 0.0 {0.550123 0.498322 0.659459} O9 7998 0.0 -1 8 {} O 0.0 {0.560357 0.479524 0.680182} O10 7999 0.0 -1 1 {} H 0.0 {0.618662 0.540725 0.657329} H18 8000 0.0 -1 1 {} H 0.0 {0.611142 0.578129 0.675423} H19 8001 0.0 -1 1 {} H 0.0 {0.615377 0.49875 0.348231} H20 8002 0.0 -1 1 {} H 0.0 {0.637131 0.613368 0.579885} H22 8003 0.0 -1 1 {} H 0.0 {0.588439 0.509457 0.696218} H24 8004 0.0 -1 1 {} H 0.0 {0.613767 0.500152 0.747792} H25 8005 0.0 -1 1 {} H 0.0 {0.583335 0.475371 0.661303} H26 8006 0.0 -1 1 {} H 0.0 {0.586458 0.548231 0.647699} H27 8007 0.0 -1 1 {} H 0.0 {0.589313 0.491294 0.654997} H28 8008 0.0 -1 1 {} H 0.0 {0.574841 0.538724 0.661089} H29 8009 0.0 -1 1 {} H 0.0 {0.561748 0.529098 0.658376} H31 8010 0.0 -1 1 {} H 0.0 {0.603465 0.544476 0.673742} H32 8011 0.0 -1 1 {} H 0.0 {0.54645 0.492004 0.651606} H33 8012 0.0 -1 1 {} H 0.0 {0.550759 0.48231 0.678237} H34 8013 0.0 -1 7 {} N 0.0 {0.610447 0.621588 0.594372} N3 8014 0.0 -1 1 {} H 0.0 {0.27513 0.375375 0.511018} H16 8015 0.0 -1 1 {} H 0.0 {0.603458 0.615058 0.591296} H17 8016 0.0 -1 7 {} N 0.0 {0.605443 0.525674 0.696558} N6 8017 0.0 -1 1 {} H 0.0 {0.424051 0.231761 0.474914} H41 8018 0.0 -1 1 {} H 0.0 {0.539757 0.494583 0.75981} H42 8019 0.0 -1 14 {} Si 0.0 {0.524982 0.408931 0.328457} Si6 8020 0.0 -1 8 {} O 0.0 {0.533224 0.421535 0.324516} O6 8021 0.0 -1 14 {} Si 0.0 {0.54155 0.434263 0.329956} Si7 8022 0.0 -1 8 {} O 0.0 {0.542783 0.428981 0.345357} O7 8023 0.0 -1 14 {} Si 0.0 {0.533878 0.41976 0.355136} Si8 8024 0.0 -1 7 {} N 0.0 {0.527723 0.424598 0.36986} N2 8025 0.0 -1 14 {} Si 0.0 {0.522623 0.418877 0.383869} Si9 8026 0.0 -1 14 {} Si 0.0 {0.526509 0.441062 0.366576} Si10 8027 0.0 -1 6 {} C 0.0 {0.303428 0.491148 0.586642} C3 8028 0.0 -1 7 {} N 0.0 {0.5545 0.443788 0.322636} N 8029 0.0 -1 8 {} O 0.0 {0.52509 0.444643 0.335451} O8 8030 0.0 -1 8 {} O 0.0 {0.515694 0.416969 0.344342} O9 8031 0.0 -1 8 {} O 0.0 {0.261762 0.589299 0.62374} O10 8032 0.0 -1 1 {} H 0.0 {0.511417 0.409451 0.349612} H18 8033 0.0 -1 1 {} H 0.0 {0.53296 0.471851 0.313121} H19 8034 0.0 -1 1 {} H 0.0 {0.527926 0.423698 0.399293} H20 8035 0.0 -1 1 {} H 0.0 {0.505007 0.415815 0.383829} H22 8036 0.0 -1 1 {} H 0.0 {0.524612 0.443912 0.348849} H24 8037 0.0 -1 1 {} H 0.0 {0.54091 0.447656 0.373814} H25 8038 0.0 -1 1 {} H 0.0 {0.31063 0.495412 0.573763} H26 8039 0.0 -1 1 {} H 0.0 {0.29609 0.497335 0.590686} H27 8040 0.0 -1 1 {} H 0.0 {0.51886 0.456299 0.268562} H28 8041 0.0 -1 1 {} H 0.0 {0.560593 0.446757 0.330341} H29 8042 0.0 -1 1 {} H 0.0 {0.550339 0.452563 0.318966} H31 8043 0.0 -1 1 {} H 0.0 {0.51918 0.438102 0.332831} H32 8044 0.0 -1 1 {} H 0.0 {0.254989 0.480264 0.674609} H33 8045 0.0 -1 1 {} H 0.0 {0.270811 0.588618 0.618866} H34 8046 0.0 -1 7 {} N 0.0 {0.525668 0.401474 0.383573} N3 8047 0.0 -1 1 {} H 0.0 {0.534247 0.398691 0.378422} H16 8048 0.0 -1 1 {} H 0.0 {0.527103 0.398545 0.393271} H17 8049 0.0 -1 7 {} N 0.0 {0.509599 0.448495 0.36982} N6 8050 0.0 -1 1 {} H 0.0 {0.503872 0.443499 0.363445} H41 8051 0.0 -1 1 {} H 0.0 {0.50814 0.444719 0.378674} H42 8052 0.0 -1 14 {} Si 0.0 {0.470515 0.350831 0.681218} Si6 8053 0.0 -1 8 {} O 0.0 {0.478484 0.361503 0.673705} O6 8054 0.0 -1 14 {} Si 0.0 {0.482911 0.375382 0.668597} Si7 8055 0.0 -1 8 {} O 0.0 {0.493196 0.378828 0.679814} O7 8056 0.0 -1 14 {} Si 0.0 {0.495978 0.383562 0.694527} Si8 8057 0.0 -1 7 {} N 0.0 {0.484109 0.397369 0.701658} N2 8058 0.0 -1 14 {} Si 0.0 {0.483034 0.411233 0.692494} Si9 8059 0.0 -1 14 {} Si 0.0 {0.471685 0.394137 0.711947} Si10 8060 0.0 -1 6 {} C 0.0 {0.467347 0.333519 0.674802} C3 8061 0.0 -1 7 {} N 0.0 {0.487469 0.376445 0.651563} N 8062 0.0 -1 8 {} O 0.0 {0.466515 0.386051 0.67731} O8 8063 0.0 -1 8 {} O 0.0 {0.45806 0.360358 0.685471} O9 8064 0.0 -1 8 {} O 0.0 {0.479448 0.352723 0.699647} O10 8065 0.0 -1 1 {} H 0.0 {0.496013 0.37238 0.70255} H18 8066 0.0 -1 1 {} H 0.0 {0.510148 0.389346 0.695046} H19 8067 0.0 -1 1 {} H 0.0 {0.470141 0.41216 0.686338} H20 8068 0.0 -1 1 {} H 0.0 {0.484082 0.425103 0.701395} H22 8069 0.0 -1 1 {} H 0.0 {0.456294 0.392322 0.706832} H24 8070 0.0 -1 1 {} H 0.0 {0.468697 0.40217 0.724332} H25 8071 0.0 -1 1 {} H 0.0 {0.476558 0.329808 0.671344} H26 8072 0.0 -1 1 {} H 0.0 {0.459454 0.333086 0.667704} H27 8073 0.0 -1 1 {} H 0.0 {0.463749 0.326958 0.682838} H28 8074 0.0 -1 1 {} H 0.0 {0.483744 0.367597 0.647654} H29 8075 0.0 -1 1 {} H 0.0 {0.483394 0.383547 0.645927} H31 8076 0.0 -1 1 {} H 0.0 {0.460868 0.377322 0.679389} H32 8077 0.0 -1 1 {} H 0.0 {0.449493 0.356299 0.682096} H33 8078 0.0 -1 1 {} H 0.0 {0.476928 0.360993 0.703658} H34 8079 0.0 -1 7 {} N 0.0 {0.498748 0.410871 0.679483} N3 8080 0.0 -1 1 {} H 0.0 {0.496039 0.412805 0.670113} H16 8081 0.0 -1 1 {} H 0.0 {0.500648 0.400793 0.679031} H17 8082 0.0 -1 7 {} N 0.0 {0.474175 0.376113 0.716601} N6 8083 0.0 -1 1 {} H 0.0 {0.464957 0.373845 0.720981} H41 8084 0.0 -1 1 {} H 0.0 {0.481146 0.373755 0.722942} H42 8085 0.0 -1 14 {} Si 0.0 {0.381667 0.559323 0.68963} Si6 8086 0.0 -1 8 {} O 0.0 {0.395761 0.558977 0.682352} O6 8087 0.0 -1 14 {} Si 0.0 {0.411779 0.559611 0.677738} Si7 8088 0.0 -1 8 {} O 0.0 {0.415112 0.567395 0.691309} O7 8089 0.0 -1 14 {} Si 0.0 {0.415772 0.581155 0.699697} Si8 8090 0.0 -1 7 {} N 0.0 {0.400367 0.591568 0.696311} N2 8091 0.0 -1 14 {} Si 0.0 {0.385272 0.58511 0.698219} Si9 8092 0.0 -1 14 {} Si 0.0 {0.399825 0.603169 0.684891} Si10 8093 0.0 -1 6 {} C 0.0 {0.377326 0.54838 0.702842} C3 8094 0.0 -1 7 {} N 0.0 {0.629879 0.442771 0.336229} N 8095 0.0 -1 8 {} O 0.0 {0.434312 0.56308 0.673151} O8 8096 0.0 -1 8 {} O 0.0 {0.37196 0.565733 0.67858} O9 8097 0.0 -1 8 {} O 0.0 {0.404197 0.462335 0.609098} O10 8098 0.0 -1 1 {} H 0.0 {0.416008 0.577322 0.714155} H18 8099 0.0 -1 1 {} H 0.0 {0.429518 0.586507 0.696805} H19 8100 0.0 -1 1 {} H 0.0 {0.379196 0.581363 0.68454} H20 8101 0.0 -1 1 {} H 0.0 {0.41064 0.46695 0.603526} H22 8102 0.0 -1 1 {} H 0.0 {0.390665 0.598922 0.671721} H24 8103 0.0 -1 1 {} H 0.0 {0.416126 0.603218 0.678734} H25 8104 0.0 -1 1 {} H 0.0 {0.37514 0.539427 0.698662} H26 8105 0.0 -1 1 {} H 0.0 {0.370482 0.553102 0.708324} H27 8106 0.0 -1 1 {} H 0.0 {0.390676 0.547493 0.711907} H28 8107 0.0 -1 1 {} H 0.0 {0.623483 0.448515 0.330839} H29 8108 0.0 -1 1 {} H 0.0 {0.638864 0.446552 0.334098} H31 8109 0.0 -1 1 {} H 0.0 {0.435895 0.569509 0.665112} H32 8110 0.0 -1 1 {} H 0.0 {0.374776 0.564494 0.66941} H33 8111 0.0 -1 1 {} H 0.0 {0.395794 0.466718 0.605814} H34 8112 0.0 -1 7 {} N 0.0 {0.374428 0.594983 0.710583} N3 8113 0.0 -1 1 {} H 0.0 {0.372538 0.60417 0.705748} H16 8114 0.0 -1 1 {} H 0.0 {0.38088 0.597047 0.718503} H17 8115 0.0 -1 7 {} N 0.0 {0.393602 0.621472 0.68929} N6 8116 0.0 -1 1 {} H 0.0 {0.396265 0.622489 0.698887} H41 8117 0.0 -1 1 {} H 0.0 {0.383292 0.621866 0.687998} H42 8118 0.0 -1 14 {} Si 0.0 {0.517112 0.329644 0.534059} Si6 8119 0.0 -1 8 {} O 0.0 {0.502292 0.331618 0.529984} O6 8120 0.0 -1 14 {} Si 0.0 {0.487606 0.328549 0.528554} Si7 8121 0.0 -1 8 {} O 0.0 {0.485536 0.318299 0.540076} O7 8122 0.0 -1 14 {} Si 0.0 {0.484112 0.314848 0.555376} Si8 8123 0.0 -1 7 {} N 0.0 {0.491817 0.301472 0.561469} N2 8124 0.0 -1 14 {} Si 0.0 {0.48911 0.289018 0.571592} Si9 8125 0.0 -1 14 {} Si 0.0 {0.506084 0.296632 0.553466} Si10 8126 0.0 -1 6 {} C 0.0 {0.522875 0.33447 0.551131} C3 8127 0.0 -1 7 {} N 0.0 {0.478902 0.343263 0.523862} N 8128 0.0 -1 8 {} O 0.0 {0.485694 0.313867 0.514096} O8 8129 0.0 -1 8 {} O 0.0 {0.523123 0.338749 0.520493} O9 8130 0.0 -1 8 {} O 0.0 {0.516409 0.311208 0.527625} O10 8131 0.0 -1 1 {} H 0.0 {0.488982 0.327514 0.565652} H18 8132 0.0 -1 1 {} H 0.0 {0.466658 0.310411 0.557284} H19 8133 0.0 -1 1 {} H 0.0 {0.477127 0.291216 0.584032} H20 8134 0.0 -1 1 {} H 0.0 {0.47871 0.279624 0.562826} H22 8135 0.0 -1 1 {} H 0.0 {0.520169 0.296663 0.562158} H24 8136 0.0 -1 1 {} H 0.0 {0.512051 0.304796 0.538958} H25 8137 0.0 -1 1 {} H 0.0 {0.528477 0.326166 0.55521} H26 8138 0.0 -1 1 {} H 0.0 {0.513846 0.335444 0.557399} H27 8139 0.0 -1 1 {} H 0.0 {0.529079 0.343049 0.551077} H28 8140 0.0 -1 1 {} H 0.0 {0.471808 0.340254 0.517144} H29 8141 0.0 -1 1 {} H 0.0 {0.484767 0.349766 0.518267} H31 8142 0.0 -1 1 {} H 0.0 {0.489664 0.306542 0.519183} H32 8143 0.0 -1 1 {} H 0.0 {0.517024 0.346319 0.519101} H33 8144 0.0 -1 1 {} H 0.0 {0.50805 0.310059 0.522232} H34 8145 0.0 -1 7 {} N 0.0 {0.506134 0.281881 0.578396} N3 8146 0.0 -1 1 {} H 0.0 {0.50953 0.275658 0.571094} H16 8147 0.0 -1 1 {} H 0.0 {0.503175 0.276482 0.586173} H17 8148 0.0 -1 7 {} N 0.0 {0.503373 0.277728 0.546901} N6 8149 0.0 -1 1 {} H 0.0 {0.497538 0.279803 0.539151} H41 8150 0.0 -1 1 {} H 0.0 {0.499365 0.27144 0.553812} H42 8151 0.0 -1 14 {} Si 0.0 {0.365187 0.495065 0.568847} Si6 8152 0.0 -1 8 {} O 0.0 {0.367825 0.500364 0.554249} O6 8153 0.0 -1 14 {} Si 0.0 {0.376499 0.504837 0.541662} Si7 8154 0.0 -1 8 {} O 0.0 {0.390769 0.506451 0.547934} O7 8155 0.0 -1 14 {} Si 0.0 {0.403591 0.513953 0.554057} Si8 8156 0.0 -1 7 {} N 0.0 {0.413405 0.526223 0.547948} N2 8157 0.0 -1 14 {} Si 0.0 {0.422039 0.540471 0.550308} Si9 8158 0.0 -1 14 {} Si 0.0 {0.413938 0.51959 0.530799} Si10 8159 0.0 -1 6 {} C 0.0 {0.371622 0.503937 0.584171} C3 8160 0.0 -1 7 {} N 0.0 {0.373998 0.494568 0.527865} N 8161 0.0 -1 8 {} O 0.0 {0.365164 0.522755 0.538575} O8 8162 0.0 -1 8 {} O 0.0 {0.368457 0.476005 0.564985} O9 8163 0.0 -1 8 {} O 0.0 {0.349143 0.493505 0.566096} O10 8164 0.0 -1 1 {} H 0.0 {0.399296 0.521997 0.570298} H18 8165 0.0 -1 1 {} H 0.0 {0.414658 0.501848 0.558686} H19 8166 0.0 -1 1 {} H 0.0 {0.432162 0.537773 0.56002} H20 8167 0.0 -1 1 {} H 0.0 {0.429795 0.543207 0.538302} H22 8168 0.0 -1 1 {} H 0.0 {0.402749 0.527431 0.523214} H24 8169 0.0 -1 1 {} H 0.0 {0.411939 0.504566 0.525914} H25 8170 0.0 -1 1 {} H 0.0 {0.372482 0.514673 0.582863} H26 8171 0.0 -1 1 {} H 0.0 {0.381414 0.499812 0.585945} H27 8172 0.0 -1 1 {} H 0.0 {0.365855 0.501803 0.592922} H28 8173 0.0 -1 1 {} H 0.0 {0.381815 0.4876 0.528066} H29 8174 0.0 -1 1 {} H 0.0 {0.375506 0.499466 0.519096} H31 8175 0.0 -1 1 {} H 0.0 {0.371299 0.530605 0.538184} H32 8176 0.0 -1 1 {} H 0.0 {0.36342 0.471602 0.572411} H33 8177 0.0 -1 1 {} H 0.0 {0.348039 0.493361 0.556013} H34 8178 0.0 -1 7 {} N 0.0 {0.407211 0.553739 0.554538} N3 8179 0.0 -1 1 {} H 0.0 {0.409024 0.558341 0.563257} H16 8180 0.0 -1 1 {} H 0.0 {0.401477 0.54608 0.55776} H17 8181 0.0 -1 7 {} N 0.0 {0.430965 0.525683 0.522238} N6 8182 0.0 -1 1 {} H 0.0 {0.43314 0.520244 0.513764} H41 8183 0.0 -1 1 {} H 0.0 {0.437652 0.521366 0.528939} H42 8184 0.0 -1 14 {} Si 0.0 {0.579663 0.610834 0.311787} Si6 8185 0.0 -1 8 {} O 0.0 {0.568676 0.611678 0.300201} O6 8186 0.0 -1 14 {} Si 0.0 {0.562164 0.607712 0.286115} Si7 8187 0.0 -1 8 {} O 0.0 {0.548658 0.600672 0.291767} O7 8188 0.0 -1 14 {} Si 0.0 {0.541277 0.588107 0.297014} Si8 8189 0.0 -1 7 {} N 0.0 {0.541732 0.579745 0.311387} N2 8190 0.0 -1 14 {} Si 0.0 {0.553763 0.585486 0.320775} Si9 8191 0.0 -1 14 {} Si 0.0 {0.53834 0.565284 0.319051} Si10 8192 0.0 -1 6 {} C 0.0 {0.574145 0.620338 0.328287} C3 8193 0.0 -1 7 {} N 0.0 {0.558823 0.622467 0.273326} N 8194 0.0 -1 8 {} O 0.0 {0.570824 0.595716 0.280704} O8 8195 0.0 -1 8 {} O 0.0 {0.591893 0.615349 0.302188} O9 8196 0.0 -1 8 {} O 0.0 {0.581235 0.590379 0.310909} O10 8197 0.0 -1 1 {} H 0.0 {0.523651 0.589354 0.297169} H18 8198 0.0 -1 1 {} H 0.0 {0.544164 0.573285 0.286464} H19 8199 0.0 -1 1 {} H 0.0 {0.562308 0.572908 0.329988} H20 8200 0.0 -1 1 {} H 0.0 {0.571334 0.588409 0.31318} H22 8201 0.0 -1 1 {} H 0.0 {0.542259 0.567075 0.333752} H24 8202 0.0 -1 1 {} H 0.0 {0.546545 0.554922 0.310825} H25 8203 0.0 -1 1 {} H 0.0 {0.569594 0.629518 0.325297} H26 8204 0.0 -1 1 {} H 0.0 {0.583297 0.621366 0.333258} H27 8205 0.0 -1 1 {} H 0.0 {0.566127 0.61613 0.333907} H28 8206 0.0 -1 1 {} H 0.0 {0.553182 0.630168 0.269317} H29 8207 0.0 -1 1 {} H 0.0 {0.564293 0.61874 0.265435} H31 8208 0.0 -1 1 {} H 0.0 {0.575861 0.592312 0.288194} H32 8209 0.0 -1 1 {} H 0.0 {0.604858 0.604332 0.293491} H33 8210 0.0 -1 1 {} H 0.0 {0.603923 0.598151 0.279052} H34 8211 0.0 -1 7 {} N 0.0 {0.549011 0.597712 0.335127} N3 8212 0.0 -1 1 {} H 0.0 {0.538694 0.598118 0.334028} H16 8213 0.0 -1 1 {} H 0.0 {0.551744 0.591897 0.34239} H17 8214 0.0 -1 7 {} N 0.0 {0.518323 0.562995 0.314569} N6 8215 0.0 -1 1 {} H 0.0 {0.518788 0.553488 0.311202} H41 8216 0.0 -1 1 {} H 0.0 {0.518828 0.568306 0.30593} H42 8217 0.0 -1 14 {} Si 0.0 {0.432881 0.49643 0.667794} Si6 8218 0.0 -1 8 {} O 0.0 {0.428557 0.508436 0.65897} O6 8219 0.0 -1 14 {} Si 0.0 {0.428753 0.52222 0.652322} Si7 8220 0.0 -1 8 {} O 0.0 {0.436953 0.530809 0.662762} O7 8221 0.0 -1 14 {} Si 0.0 {0.448888 0.540277 0.666425} Si8 8222 0.0 -1 7 {} N 0.0 {0.458876 0.536859 0.679722} N2 8223 0.0 -1 14 {} Si 0.0 {0.463118 0.545224 0.693638} Si9 8224 0.0 -1 14 {} Si 0.0 {0.462203 0.521488 0.683991} Si10 8225 0.0 -1 6 {} C 0.0 {0.424168 0.492918 0.682001} C3 8226 0.0 -1 7 {} N 0.0 {0.437573 0.523891 0.634099} N 8227 0.0 -1 8 {} O 0.0 {0.413399 0.52755 0.652785} O8 8228 0.0 -1 8 {} O 0.0 {0.453679 0.499589 0.665511} O9 8229 0.0 -1 8 {} O 0.0 {0.43392 0.48297 0.653206} O10 8230 0.0 -1 1 {} H 0.0 {0.458498 0.542808 0.654128} H18 8231 0.0 -1 1 {} H 0.0 {0.440611 0.554795 0.672016} H19 8232 0.0 -1 1 {} H 0.0 {0.45189 0.546599 0.70601} H20 8233 0.0 -1 1 {} H 0.0 {0.476317 0.536425 0.699791} H22 8234 0.0 -1 1 {} H 0.0 {0.456892 0.509144 0.67145} H24 8235 0.0 -1 1 {} H 0.0 {0.455305 0.515947 0.696292} H25 8236 0.0 -1 1 {} H 0.0 {0.434304 0.530919 0.689244} H26 8237 0.0 -1 1 {} H 0.0 {0.415623 0.498979 0.683527} H27 8238 0.0 -1 1 {} H 0.0 {0.423105 0.481882 0.681195} H28 8239 0.0 -1 1 {} H 0.0 {0.446079 0.528758 0.633109} H29 8240 0.0 -1 1 {} H 0.0 {0.441539 0.514325 0.633129} H31 8241 0.0 -1 1 {} H 0.0 {0.413302 0.537032 0.656622} H32 8242 0.0 -1 1 {} H 0.0 {0.456066 0.500429 0.655448} H33 8243 0.0 -1 1 {} H 0.0 {0.441358 0.487222 0.648682} H34 8244 0.0 -1 7 {} N 0.0 {0.470445 0.563119 0.689803} N3 8245 0.0 -1 1 {} H 0.0 {0.472854 0.56647 0.699227} H16 8246 0.0 -1 1 {} H 0.0 {0.461298 0.567422 0.686657} H17 8247 0.0 -1 7 {} N 0.0 {0.479208 0.513428 0.680419} N6 8248 0.0 -1 1 {} H 0.0 {0.478623 0.503267 0.681377} H41 8249 0.0 -1 1 {} H 0.0 {0.484893 0.516353 0.688481} H42 8250 0.0 -1 @end @Columns Cell Constraints string {a b c A B G} Origin int {{0 0 0}} Parameters double {{10.0 10.0 10.0 90.0 90.0 90.0}} PrimitiveData double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} RotationMatrix double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} SpaceGroup string P1 SpaceGroupNumber int 1 ToCartesians double {{{10.0 0.0 0.0} {0.0 10.0 0.0} {0.0 0.0 10.0}}} ToFractionals double {{{0.10000000000000001 0.0 0.0} {0.0 0.10000000000000001 0.0} {0.0 0.0 0.10000000000000001}}} @end @data {a b c A B G} {0 0 0} {100 100 100 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{100 0 0} {0 100 0} {0 0 100}} {{0.01 0 0} {0 0.01 0} {0 0 0.01}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data @end @Columns Bond AsymmetricBond reference AsymmetricBond Atom1 reference Atom Atom2 reference Atom CellOffset2 int {{0 0 0}} Key int 0 @end @data @end @Columns Subset Color string {{#65d9f0}} Criteria string {{}} DisplayLine int 0 IeqJ int 1 IgtJ int 0 IltJ int 0 Length int 1 Name string {{}} Table string {{}} Type string atom UseColor int 0 @end @data @end}} } Namespace { ::thread { } } Namespace { ::tsv { } } Namespace { ::tpool { } } Namespace { ::chemistry { } } Namespace { ::chemistry::PeriodicTable { scalar ::chemistry::PeriodicTable::gProperties {symbol {atomic radius} {covalent radius} {atomic number} {atomic mass} {discovery date} {electrical conductivity} {thermal conductivity} {specific heat} electronegativity {boiling point} {melting point} density {atomic volume} {lattice spacing a} structure {c/a, alpha, b/a} {coherent scattering length} {incoherent X-section} {absorption @1.8A} name state valency {ldf spin-polarization energy} {atomic heat of formation at 0 K} {Pettifor index} {alternate radius}} scalar ::chemistry::PeriodicTable::gSymbols {X H He Li Be B C N O F Ne Na Mg Al Si P S Cl Ar K Ca Sc Ti V Cr Mn Fe Co Ni Cu Zn Ga Ge As Se Br Kr Rb Sr Y Zr Nb Mo Tc Ru Rh Pd Ag Cd In Sn Sb Te I Xe Cs Ba La Ce Pr Nd Pm Sm Eu Gd Tb Dy Ho Er Tm Yb Lu Hf Ta W Re Os Ir Pt Au Hg Tl Pb Bi Po At Rn Fr Ra Ac Th Pa U Np Pu Am Cm Bk Cf Es Fm Md No Lr Rf Db Sg Bh Hs Mt Ds Rg Cn Nh Fl Mc Lv Ts Og } scalar ::chemistry::PeriodicTable::gType {{} continuous continuous continuous continuous continuous continuous continuous continuous continuous continuous continuous continuous continuous continuous discrete {} continuous continuous continuous {} discrete discrete continuous continuous discrete continuous} scalar ::chemistry::PeriodicTable::gUnits {{} Ang Ang {} amu {} {10^6 / (cm * ohm)} {W /(cm * K)} {[J/g/K]} {} K\] K {} {} Ang {} {} {1.0E-12 cm} barn barn {} {} {} kJ/mol kJ/mol {} Ang} scalar ::chemistry::PeriodicTable::gNElements 118 scalar ::chemistry::PeriodicTable::gElementData {{X --- --- 0 0.0 ---- --- ---- --- --- --- --- --- --- --- --- --- --- --- --- Dummy --- --- --- --- 999 1.10} {H 0.79 0.32 1 1.00794 1766 --- 0.001815 14.304 2.20 20.268 14.025 0.0899 14.4 3.75 HEX --- -0.374 79.9 0.3326 Hydrogen gas 1 86.64 216.035 103 0.20} {He 0.49 0.93 2 4.002602 1895 --- 0.00152 5.193 --- 4.215 0.95 0.1787 0.0 3.57 HEX --- 0.326 0.0 0.00747 Helium gas 0 0.00 0 1 1.00} {Li 2.05 1.23 3 6.941 1817 0.108 0.847 3.6 0.98 1615 453.7 0.53 13.10 3.49 BCC --- -0.190 0.91 70.5 Lithium solid 1 23.00 157.735 12 0.90} {Be 1.40 0.90 4 9.012182 1798 0.313 2.00 1.82 1.57 2745 1560.0 1.85 5.0 2.29 HEX 1.567 0.779 0.005 0.0076 Beryllium solid 2 0.00 319.753 77 0.80} {B 1.17 0.82 5 10.811 1828 1.0e-12 0.270 1.02 2.04 4275 2300.0 2.34 4.6 8.73 TET 0.576 0.530 1.7 767.0 Boron solid 3 24.72 559.906 86 0.65} {C 0.91 0.77 6 12.011 ???? 0.00061 1.29 0.71 2.55 4470.0 4100.0 2.62 4.58 3.57 DIA --- 0.6648 0.001 0.0035 Carbon solid 4 116.26 711.194 95 0.70} {N 0.75 0.75 7 14.00674 1772 --- 0.0002598 1.04 3.04 77.35 63.14 1.251 17.3 4.039 HEX 1.051 0.936 0.49 1.90 Nitrogen gas 3 293.49 470.818 100 0.80} {O 0.65 0.73 8 15.9994 1774 --- 0.0002674 0.92 3.44 90.18 50.35 1.429 14.0 6.83 CUB --- 0.5805 0.000 0.00019 Oxygen gas 2 142.65 246.795 101 0.90} {F 0.57 0.72 9 18.9984032 1886 --- 0.000279 0.82 3.98 84.95 53.48 1.696 17.1 --- MCL --- 0.5654 0.0008 0.0096 Fluorine gas 1 38.19 77.2745 102 0.95} {Ne 0.51 0.71 10 20.1797 1898 --- 0.000493 0.904 --- 27.096 24.553 0.901 16.7 4.43 FCC --- 0.4547 0.008 0.039 Neon gas 0 0.00 0 2 1.40} {Na 2.23 1.54 11 22.989768 1807 0.139 1.41 1.23 0.93 1156 371.0 0.97 23.7 4.23 BCC --- 0.363 1.62 0.530 Sodium solid 1 19.86 107.763 11 1.10} {Mg 1.72 1.36 12 24.3050 1808 0.226 1.56 1.02 1.31 1363 922 1.74 13.97 3.21 HEX 1.624 0.5375 0.077 0.063 Magnesium solid 2 0.00 145.901 73 0.95} {Al 1.82 1.18 13 26.981539 1825 0.377 2.37 0.90 1.61 2793 933.25 2.70 10.0 4.05 FCC --- 0.3449 0.0085 0.231 Aluminum solid 3 14.66 327.621 80 0.85} {Si 1.46 1.11 14 28.0855 1823 2.52e-12 1.48 0.71 1.90 3540.0 1685 2.33 12.1 5.43 DIA --- 0.4149 0.015 0.171 Silicon solid 4 64.45 445.667 85 0.80} {P 1.23 1.06 15 30.97362 1669 1.0e-17 0.00235 0.77 2.19 550.0 317.30 1.82 17.0 7.17 CUB --- 0.513 0.006 0.172 Phosphorus solid 3 156.41 315.663 90 0.90} {S 1.09 1.02 16 32.066 ???? 0.5e-23 0.00269 0.71 2.58 717.75 388.36 2.07 15.5 10.47 ORC 2.339/1.229 0.2847 0.007 0.53 Sulfur solid 2 73.16 274.925 94 1.25} {Cl 0.97 0.99 17 35.4527 1774 --- 0.000089 0.48 3.16 239.1 172.16 3.17 22.7 6.24 ORC 1.324/0.718 0.95792 5.2 33.5 Chlorine gas 1 19.12 119.6195 99 1.35} {Ar 0.88 0.98 18 39.948 1894 --- 0.0001772 0.520 --- 87.30 83.81 1.784 28.5 5.26 FCC --- 0.1909 0.22 0.675 Argon gas 0 0.00 0 3 1.70} {K 2.77 2.03 19 39.0983 1807 0.139 1 0.75 0.82 1032 336.35 0.86 45.46 5.23 BCC --- 0.371 0.25 2.1 Potassium solid 1 14.29 89.891 10 1.50} {Ca 2.23 1.91 20 40.078 1808 0.298 2.00 0.63 1.00 1757 1112 1.55 29.9 5.58 FCC --- 0.490 0.03 0.43 Calcium solid 2 0.00 177.339 16 1.30} {Sc 2.09 1.62 21 44.955910 1879 0.0177 0.158 0.6 1 3104 1812 3.0 15.0 3.31 HEX 1.594 1.229 4.5 27.2 Scandium solid 3 15.68 376.22 19 1.05} {Ti 2.00 1.45 22 47.88 1791 0.0234 0.219 0.52 1.54 3562 1943 4.50 10.64 2.95 HEX 1.588 -0.330 2.67 6.09 Titanium solid 4 68.91 470.285 51 1.00} {V 1.92 1.34 23 50.9415 1830 0.0489 0.307 0.49 1.63 3682 2175 5.8 8.78 3.02 BCC --- -0.0382 5.187 5.08 Vanadium solid 5 166.19 514.84 54 0.98} {Cr 1.85 1.18 24 51.9961 1797 0.0774 0.937 0.45 1.66 2945 2130.0 7.19 7.23 2.88 BCC --- 0.3635 1.83 3.07 Chromium solid 3 493.88 394.86 57 0.97} {Mn 1.79 1.17 25 54.93085 1774 0.00695 0.0782 0.48 1.55 2335 1517 7.43 1.39 8.89 FCC --- -0.373 0.40 13.3 Manganese solid 2 511.24 279.8 60 0.96} {Fe 1.72 1.17 26 55.847 ???? 0.0993 0.802 0.44 1.83 3135 1809 7.86 7.1 2.87 BCC --- 0.954 0.39 2.56 Iron solid 2 341.93 411.405 61 0.95} {Co 1.67 1.16 27 58.93320 1737 0.172 1.00 0.42 1.88 3201 1768 8.90 6.7 2.51 HEX 1.622 0.250 4.8 37.18 Cobalt solid 2 199.63 423.41 64 0.94} {Ni 1.62 1.15 28 58.69 1751 0.143 0.907 0.44 1.91 3187 1726 8.90 6.59 3.52 FCC --- 1.03 5.2 4.49 Nickel solid 2 91.65 427.97 67 0.93} {Cu 1.57 1.17 29 63.546 ???? 0.596 4.01 0.38 1.90 2836 1357.6 8.96 7.1 3.61 FCC --- 0.7718 0.52 3.78 Copper solid 2 19.68 336.207 72 0.95} {Zn 1.53 1.25 30 65.39 1746 0.166 1.16 0.39 1.65 1180.0 692.73 7.14 9.2 2.66 HEX 1.856 0.5680 0.077 1.11 Zinc solid 2 0.00 129.86 76 1.00} {Ga 1.81 1.26 31 69.723 1875 0.0678 0.406 0.37 1.81 2478 302.90 5.91 11.8 4.51 ORC 1.695/1.001 0.7288 0.0 2.9 Gallium solid 3 14.36 276.02 81 0.90} {Ge 1.52 1.22 32 72.61 1886 1 0.599 0.32 2.01 3107 1210.4 5.32 13.6 5.66 DIA --- 0.81929 0.17 2.3 Germanium solid 4 59.15 369.238 84 0.85} {As 1.33 1.20 33 74.92159 ???? 0.0345 0.500 0.33 2.18 876 1081 5.72 13.1 4.13 RHL 54\"10' 0.658 0.060 4.5 Arsenic solid 3 136.99 301.93 89 1.00} {Se 1.22 1.16 34 78.96 1817 1.0e-12 0.0204 0.32 2.55 958 494 4.80 16.45 4.36 HEX 1.136 0.797 0.33 11.7 Selenium solid 2 61.67 226.421 93 1.30} {Br 1.12 1.14 35 79.904 1826 --- 0.00122 0.473 2.96 332.25 265.90 3.12 23.5 6.67 ORC 1.307/0.672 0.679 0.10 6.9 Bromine liquid 1 15.62 117.933 98 1.40} {Kr 1.03 1.12 36 83.80 1898 --- 0.0000949 0.248 --- 119.80 115.78 3.74 38.9 5.72 FCC --- 0.780 0.03 25. Krypton gas 0 0.00 0 4 1.90} {Rb 2.98 2.16 37 85.4678 1861 0.0779 0.582 0.363 0.82 961 312.64 1.53 55.9 5.59 BCC --- 0.708 0.3 0.38 Rubidium solid 1 12.78 82.192 9 1.80} {Sr 2.45 1.91 38 87.62 1790 0.0762 0.353 0.30 0.95 1650.0 1041 2.6 33.7 6.08 FCC --- 0.702 0.04 1.28 Strontium solid 2 0.00 164 15 1.60} {Y 2.27 1.62 39 88.90585 1794 0.0166 0.172 0.30 1.22 3611 1799 4.5 19.8 3.65 HEX 1.571 0.775 0.15 1.28 Yttrium solid 3 11.91 420.11 25 1.30} {Zr 2.16 1.45 40 91.224 1789 0.0236 0.227 0.27 1.33 4682 2125 6.49 14.1 3.23 HEX 1.593 0.716 0.16 0.185 Zirconium solid 4 51.13 607.71 49 1.15} {Nb 2.09 1.34 41 92.90638 1801 0.0693 0.537 0.26 1.6 5017 2740.0 8.55 10.87 3.30 BCC --- 0.7054 0.0024 1.15 Niobium solid 5 261.09 722.89 53 1.12} {Mo 2.01 1.30 42 95.94 1778 0.187 1.38 0.25 2.16 4912 2890.0 10.2 9.4 3.15 BCC --- 0.695 0.28 2.55 Molybdenum solid 6 392.14 656.393 56 1.11} {Tc 1.95 1.27 43 98.91 1937 0.067 0.506 0.21 1.9 4538 2473 11.5 8.5 2.74 HEX 1.604 0.68 0.0 20.0 Technetium solid ? 359.05 678 59 1.10} {Ru 1.89 1.25 44 101.07 1844 0.137 1.17 0.238 2.2 4423 2523 12.2 8.3 2.70 HEX 1.584 0.721 0.07 2.56 Ruthenium solid 3 166.40 641.37 62 1.09} {Rh 1.83 1.25 45 102.90550 1803 0.211 1.50 0.242 2.28 3970.0 2236 12.4 8.3 3.90 FCC --- 0.588 0.0 145.0 Rhodium solid 3 88.99 555.71 65 1.08} {Pd 1.79 1.28 46 106.42 1803 0.0950 0.718 0.24 2.20 3237 1825 12.0 8.9 3.89 FCC --- 0.591 0.093 6.9 Palladium solid 2 0.00 377.24 69 1.07} {Ag 1.75 1.34 47 107.8682 ???? 0.630 4.29 0.235 1.93 2436 1234 10.5 10.3 4.09 FCC --- 0.5922 0.58 63.3 Silver solid 1 16.11 284.45 71 1.10} {Cd 1.71 1.48 48 112.411 1817 0.138 0.968 0.23 1.69 1040.0 594.18 8.65 13.1 2.98 HEX 1.886 0.51 2.4 2520.0 Cadmium solid 2 0.00 111.85 75 1.20} {In 2.00 1.44 49 114.82 1863 0.116 0.816 0.23 1.78 2346 429.76 7.31 15.7 4.59 TET 1.076 0.4065 0.54 193.8 Indium solid 3 12.46 243.7 79 1.05} {Sn 1.72 1.41 50 118.710 ???? 0.0917 0.666 0.227 1.96 2876 505.06 7.30 16.3 5.82 TET 0.546 0.6228 0.022 0.626 Tin solid 4 49.86 301.308 83 1.00} {Sb 1.53 1.40 51 121.75 ???? 0.0288 0.243 0.21 2.05 1860.0 904 6.68 18.23 4.51 RHL 58\"6' 0.5641 0.3 5.1 Antimony solid 3 113.05 262.7 88 1.30} {Te 1.42 1.36 52 127.60 1782 2.0e-6 0.0235 0.20 2.1 1261 722.65 6.24 20.5 4.45 HEX 1.33 0.543 0.02 4.7 Tellurium solid 2 50.05 196.62 92 1.70} {I 1.32 1.33 53 126.90447 1804 8.0e-16 0.00449 0.214 2.66 458.4 386.7 4.92 25.74 7.27 ORC 1.347/0.659 0.528 0.0 6.2 Iodine solid 1 12.51 113.759 97 1.80} {Xe 1.24 1.31 54 131.29 1898 --- 0.0000569 0.158 --- 165.03 161.36 5.89 37.3 6.20 FCC --- 0.485 0.0 23.9 Xenon gas 0 0.00 0 5 2.10} {Cs 3.34 2.35 55 132.90543 1860 0.0489 0.359 0.24 0.79 944 301.55 1.87 71.07 6.05 BCC --- 0.542 0.21 29.0 Cesium solid 1 10.91 78.014 8 1.80} {Ba 2.78 1.98 56 137.327 1808 0.030 0.184 0.204 0.89 2171 1002 3.5 39.24 5.02 BCC --- 0.525 0.01 1.2 Barium solid 2 0.00 181.7 14 1.60} {La 2.74 1.69 57 138.9055 1839 0.0126 0.135 0.19 1.10 3730.0 1193 6.7 20.73 3.75 HEX 1.619 0.824 1.13 8.97 Lanthanum solid 3 10.68 431.36 33 1.30} {Ce 2.70 1.65 58 140.115 1803 0.0115 0.114 0.19 1.12 3699 1071 6.78 20.67 5.16 FCC --- 0.484 0.0 0.63 Cerium solid 3 33.37 424.33 32 1.20} {Pr 2.67 1.65 59 140.90765 1885 0.0148 0.125 0.19 1.13 3785 1204 6.77 20.8 3.67 HEX 1.614 0.445 0.016 11.5 Praseodymium solid 3 134.97 357.08 31 1.19} {Nd 2.64 1.64 60 144.24 1925 0.0157 0.165 0.19 1.14 3341 1289 7.00 20.6 3.66 HEX 1.614 0.769 11. 50.5 Neodymium solid 3 248.46 328.93 30 1.18} {Pm 2.62 1.63 61 146.9151 1945 --- 0.179 0.18 1.13 3785 1204 6.475 22.39 --- --- --- 1.26 1.3 168.4 Promethium solid 3 399.56 --- 29 1.17} {Sm 2.59 1.62 62 150.36 1879 0.00956 0.133 0.20 1.17 2064 1345 7.54 19.95 9.00 RHL 23\"13' 0.42 50. 5670. Samarium solid 3 589.70 206.43 28 1.16} {Eu 2.56 1.85 63 151.965 1901 0.0112 0.139 0.18 1.2 1870.0 1090.0 5.26 28.9 4.61 BCC --- 0.668 2.2 4600. Europium solid 3 820.13 176.8 18 1.15} {Gd 2.54 1.61 64 157.25 1880 0.00736 0.106 0.23 1.20 3539 1585 7.89 19.9 3.64 HEX 1.588 0.95 158.0 48890. Gadolinium solid 3 949.67 398.47 27 1.14} {Tb 2.51 1.59 65 158.92534 1843 0.00889 0.111 0.18 1.2 3496 1630.0 8.27 19.2 3.60 HEX 1.581 0.738 0.004 23.4 Terbium solid 3 436.00 390.91 26 1.13} {Dy 2.49 1.59 66 162.50 1886 0.0108 0.107 0.17 1.22 2835 1682 8.54 19.0 3.59 HEX 1.573 1.69 54.5 940. Dysprosium solid 3 283.86 291.8 24 1.12} {Ho 2.47 1.58 67 164.93032 1878 0.0124 0.162 0.16 1.23 2968 1743 8.80 18.7 3.58 HEX 1.570 0.808 0.36 64.7 Holmium solid 3 162.17 302.8 23 1.11} {Er 2.45 1.57 68 167.26 1843 0.0117 0.143 0.17 1.24 3136 1795 9.05 18.4 3.56 HEX 1.570 0.803 1.2 159.2 Erbium solid 3 73.11 318.18 22 1.10} {Tm 2.42 1.56 69 168.93421 1879 0.0150 0.168 0.16 1.25 2220.0 1818 9.33 18.1 3.54 HEX 1.570 0.705 0.41 105. Thulium solid 3 18.52 233.19 21 1.09} {Yb 2.40 1.74 70 173.04 1878 0.0351 0.349 0.15 1.1 1467 1097 6.98 24.79 5.49 FCC --- 1.24 3.0 35.1 Ytterbium solid 3 0.00 152.51 17 1.08} {Lu 2.25 1.56 71 174.967 1907 0.0185 0.164 0.15 1.27 3668 1936 9.84 17.78 3.51 HEX 1.585 0.73 0.1 76.4 Lutetium solid 3 11.53 428.18 20 1.07} {Hf 2.16 1.44 72 178.49 1923 0.0312 0.230 0.14 1.3 4876 2500.0 13.1 13.6 3.20 HEX 1.582 0.777 2.6 104.1 Hafnium solid 4 48.55 618.65 50 1.15} {Ta 2.09 1.34 73 180.9479 1802 0.0761 0.575 0.14 1.5 5731 3287 16.6 10.90 3.31 BCC --- 0.691 0.02 20.6 Tantalum solid 5 112.72 781.44 52 1.12} {W 2.02 1.30 74 183.85 1783 0.189 1.74 0.13 2.36 5828 3680.0 19.3 9.53 3.16 BCC --- 0.477 2.00 18.4 Tungsten solid 6 204.93 847.76 55 1.11} {Re 1.97 1.28 75 186.207 1925 0.0542 0.479 0.13 1.9 5869 3453 21.0 8.85 2.76 HEX 1.615 0.92 0.9 90.7 Rhenium solid 5 325.85 769.22 58 1.10} {Os 1.92 1.26 76 190.2 1804 0.109 0.876 0.13 2.2 5285 3300.0 22.4 8.49 2.74 HEX 1.579 1.10 0.4 16.0 Osmium solid 4 210.26 791 63 1.09} {Ir 1.87 1.27 77 192.22 1804 0.197 1.47 0.130 2.20 4701 2716 22.5 8.54 3.84 FCC --- 1.06 0.2 425.3 Iridium solid 4 119.17 664.07 66 1.08} {Pt 1.83 1.30 78 195.08 1735 0.0966 0.716 0.13 2.28 4100.0 2045 21.4 9.10 3.92 FCC --- 0.963 0.13 10.3 Platinum solid 4 36.06 564.16 68 1.07} {Au 1.79 1.34 79 196.96654 ???? 0.452 3.17 0.128 2.54 3130.0 1337.58 19.3 10.2 4.08 FCC --- 0.763 0.36 98.65 Gold solid 3 14.78 365.81 70 1.10} {Hg 1.76 1.49 80 200.59 ???? 0.0104 0.0834 0.139 2.00 630.0 234.28 13.53 14.82 2.99 RHL 70\"45' 1.266 6.7 372.3 Mercury liquid 2 0.00 64.525 74 1.20} {Tl 2.08 1.48 81 204.3833 1861 0.0617 0.461 0.13 2.04 1746 577 11.85 17.2 3.46 HEX 1.599 0.8785 0.14 3.43 Thallium solid 3 11.75 182.83 78 1.20} {Pb 1.81 1.47 82 207.2 ???? 0.0481 0.353 0.13 2.33 2023 600.6 11.4 18.17 4.95 FCC --- 0.94003 0.003 0.171 Lead solid 4 46.28 195.873 82 1.10} {Bi 1.63 1.46 83 208.98037 ???? 0.00867 0.0787 0.12 2.02 1837 544.52 9.8 21.3 4.75 RHL 58\"14' 0.85256 0.0072 0.0338 Bismuth solid 3 103.69 207.23 87 1.30} {Po 1.53 1.46 84 209.98 1898 0.0219 0.20 0.12 2.0 1235 527 9.4 22.23 3.35 SC --- --- --- --- Polonium solid 2 45.46 --- 91 1.90} {At 1.43 1.45 85 209.9871 1940 --- 0.017 --- 2.2 610.0 575 --- --- --- --- --- --- --- --- Astatine solid 1 11.27 --- 96 2.00} {Rn 1.34 1.43 86 (222) 1898 --- 0.0000364 0.09 --- 211 202 9.91 50.5 --- --- --- --- --- --- Radon gas 0 0.00 0 6 2.20} {Fr 3.50 2.50 87 223.0197 1939 0.03 0.15 --- 0.7 950.0 300.0 --- --- --- --- --- 0.8495 0.0072 0.036 Francium solid 1 10.15 --- 7 2.00} {Ra 3.00 2.40 88 226.025 1898 --- 0.186 0.12 0.9 1809 973 5 45.20 --- --- --- 1.0 0.0 12.8 Radium solid 2 0.00 159 13 1.50} {Ac 3.20 2.20 89 227.028 1899 --- 0.12 --- 1.1 3473 1323 10.07 22.54 5.31 FCC --- --- --- --- Actinium solid 3 9.74 406 48 1.30} {Th 3.16 1.65 90 232.0381 1828 0.0653 0.540 0.12 1.3 5061 2028 11.7 19.9 5.08 FCC --- 0.984 0.0 7.37 Thorium solid 3 39.72 602 47 1.20} {Pa 3.14 1.535 91 231.03588 1917 0.0529 0.47 0.12 1.5 --- --- 15.4 15.0 3.92 TET 0.825 0.91 0.0 200.6 Protactinium solid 3 75.76 607 46 1.10} {U 3.11 1.42 92 238.0289 1789 0.0380 0.276 0.12 1.38 4407 1405 18.90 12.59 2.85 ORC 2.056/1.736 0.8417 0.004 7.57 Uranium solid 3 148.67 533 45 1.10} {Np 3.08 1.42 93 237.048 1940 0.00822 0.063 0.12 1.36 --- 910.0 20.4 11.62 4.72 ORC 1.411/1.035 1.055 0.0 175.9 Neptunium solid 3 {} --- 44 1.10} {Pu 3.05 1.42 94 244.0642 1940 0.00666 0.0674 0.13 1.28 3503 913 19.8 12.32 --- MCL --- 1.41 0.0 558. Plutonium solid 3 {} --- 43 1.10} {Am 3.02 --- 95 243.061375 1945 0.022 0.1 0.11 1.3 2880.0 1268 13.6 17.86 --- --- --- 0.83 0.0 75.3 Americium solid 3 {} --- 42 1.10} {Cm 2.99 --- 96 247.0703 1944 --- 0.1 --- 1.3 --- 1340.0 13.511 18.28 --- --- --- 0.7 0.0 0.0 Curium solid 3 {} --- 41 1.10} {Bk 2.97 --- 97 (247) 1949 --- 0.1 --- 1.3 --- --- --- --- --- --- --- --- --- --- Berkelium solid 3 {} --- 40 1.10} {Cf 2.95 --- 98 (251) 1950 --- 0.1 --- 1.3 --- 900.0 --- --- --- --- --- --- --- --- Californium solid 3 {} --- 39 1.10} {Es 2.92 --- 99 (252) 1952 --- 0.1 --- 1.3 --- --- --- --- --- --- --- --- --- --- Einsteinium solid 3 {} --- 38 1.10} {Fm 2.90 --- 100 257.0951 1953 --- 0.1 --- 1.3 --- --- --- --- --- --- --- --- --- --- Fermium solid 3 {} --- 37 1.10} {Md 2.87 --- 101 (258) 1955 --- 0.1 --- 1.3 --- --- --- --- --- --- --- --- --- --- Mendelevium solid 3 {} --- 36 1.10} {No 2.85 --- 102 (259) 1957 --- 0.1 --- 1.3 --- --- --- --- --- --- --- --- --- --- Nobelium solid 3 {} --- 35 1.10} {Lr 2.82 --- 103 (266) 1961 --- 0.1 --- --- --- --- --- --- --- --- --- --- --- --- Lawrencium solid 3 {} --- 34 1.10} {Rf --- --- 104 261.1087 1964 --- 0.23 --- --- --- --- --- --- --- --- --- --- --- --- Rutherfordium solid ? {} --- 104 1.10} {Db --- --- 105 262.1138 1970 --- 0.58 --- --- --- --- --- --- --- --- --- --- --- --- Dubnium solid ? {} --- 105 1.10} {Sg --- --- 106 263.1182 1974 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Seaborgium solid ? {} --- 106 1.10} {Bh --- --- 107 262.1229 1976 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Bohrium solid ? {} --- 107 1.10} {Hs --- --- 108 (270) 1984 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Hassium solid ? {} --- 108 1.10} {Mt --- --- 109 (268) 1982 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Meitnerium solid ? {} --- 109 1.10} {Ds --- --- 110 (281) 1994 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Darmstadtium solid ? {} --- {} 1.10} {Rg --- --- 111 (280) 1994 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Roentgenium solid ? {} {} {} {}} {Cn --- --- 112 (277) 1996 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Copernicium solid ? {} {} {} {}} {Nh --- --- 113 (287) 2003 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Nihonium solid ? {} {} {} {}} {Fl --- --- 114 (289) 1999 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Flerovium solid ? {} {} {} {}} {Mc --- --- 115 (289) 2004 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Moscovium solid ? {} {} {} {}} {Lv --- --- 116 (293) 2000 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Livermorium solid ? {} {} {} {}} {Ts --- --- 117 (294) 2010 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Tennessine solid ? {} {} {} {}} {Og --- --- 118 (294) 2006 --- --- --- --- --- --- --- --- --- --- --- --- --- --- Oganesson solid ? {} {} {} {}}} } } }