job.id 462 job.name {3D AM_6OH NEW sphere init velocity-NVT 0.2.fs, 2000ps to sphere} job.description { } job.status finished job.submitted {2025-01-06 20:54:19} job.started {2025-01-06 20:54:19} job.finished {2025-01-07 22:22:13} job.queue 6 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 $fd } } data.StageHandler {Class ::MD::Stage::Handler Version 1.2 Stages { md-lammps-stage-e057e4bd-eca3-48f4-81fb-c826cd05f428 MD::LAMMPS::Batch ::MD::LAMMPS::Stage { Base { Class ::MD::LAMMPS::Stage Version 1.2 Id md-lammps-stage-e057e4bd-eca3-48f4-81fb-c826cd05f428 Options {-results ::Results -ff ::fF0 -stageid 1 -stdout stdout -master .flowchartDialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} Arrays { myInput {in,text in in,connectedFrom {md-stage-variables-a1cc5d9a-aea8-4d1f-9bfe-34484a9df9e8 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-stage-start-9a3a70a0-9764-432f-a16d-d1fd960f5c62 {} ::MD::Stage::Start { Class ::MD::Stage::Start Version 1.2 Id md-stage-start-9a3a70a0-9764-432f-a16d-d1fd960f5c62 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 {$system} -workingdirectory .} } md-lammps-stage-a2a00c82-a350-4c32-905a-e1771a0950db MD::LAMMPS::Batch ::MD::LAMMPS::Stage::Initialize { Class ::MD::LAMMPS::Stage::Initialize Version 1.2 Id md-lammps-stage-a2a00c82-a350-4c32-905a-e1771a0950db Options {-architecture GPU -useqeqsm 1 -useqeqreax 1 -nonbondcutoff 9.5 -tailcorrections 1 -kspace_line {} -qeqsmtol 1.0e-6 -qeqreaxtol 1.0e-6 -qeqcombfreq 1 -nonbondmethod PPPM -qeqcombtol 0.01 -nonbondprecision 0.00001 -qeqsmiter 100 -nonbondskin 2.0 -qeqcombwrite 0 -qeqsmfreq 1 -qeqreaxfreq 1 -periodicity {3-d periodic} -useqeqcomb 1 -ff ::fF0 -stageid 1 -stdout stdout -master .flowchartDialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} Arrays { myInput {in,text in in,anchor n in,connectedFrom {md-stage-start-9a3a70a0-9764-432f-a16d-d1fd960f5c62 out}} myOutput {out,text out out,connectedTo {md-lammps-stage-5a30a76d-2f72-4982-8f8c-dbf1386e799c in} out,anchor s} } } md-lammps-stage-500bb802-d63d-443f-b595-5b205cda17b2 MD::LAMMPS::Batch ::MD::LAMMPS::Stage::NVT { Class ::MD::LAMMPS::Stage::NVT Version 1.2 Id md-lammps-stage-500bb802-d63d-443f-b595-5b205cda17b2 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-46ebc78a-aca7-4e73-aa08-1b917a007570 MD::LAMMPS::Batch ::MD::LAMMPS::Stage::Velocities { Class ::MD::LAMMPS::Stage::Velocities Version 1.2 Id md-lammps-stage-46ebc78a-aca7-4e73-aa08-1b917a007570 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 {} } } } Connections { md-lammps-stage-a2a00c82-a350-4c32-905a-e1771a0950db,md-lammps-stage-46ebc78a-aca7-4e73-aa08-1b917a007570 1 md-lammps-stage-46ebc78a-aca7-4e73-aa08-1b917a007570,md-lammps-stage-500bb802-d63d-443f-b595-5b205cda17b2 1 md-stage-start-9a3a70a0-9764-432f-a16d-d1fd960f5c62,md-lammps-stage-a2a00c82-a350-4c32-905a-e1771a0950db 1 } ViewControl-canvas_flowchart { Class ::MDFC::CanvasFlowchart Version 1.2 Background #eff0f1 Steps { md-flowchart-circle1-3ab37d25-fd1f-4750-b083-237344e1dc65 ::MDFC::CanvasFlowchart::Circle1 { Class ::MDFC::CanvasFlowchart::Circle1 Version 1.2 Id md-flowchart-circle1-3ab37d25-fd1f-4750-b083-237344e1dc65 Options {-height 50 -selected 0 -description {} -fill LightBlue -x 110 -width 50 -y 14 -title Start -stage md-stage-start-9a3a70a0-9764-432f-a16d-d1fd960f5c62} } md-flowchart-oval-823917f3-c034-4aad-b4c4-672518f3a6b2 ::MDFC::CanvasFlowchart::Oval { Class ::MDFC::CanvasFlowchart::Oval Version 1.2 Id md-flowchart-oval-823917f3-c034-4aad-b4c4-672518f3a6b2 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-a2a00c82-a350-4c32-905a-e1771a0950db} } md-flowchart-rectangle-b0202a04-60e9-41e9-b4b5-aca3736b804c ::MDFC::CanvasFlowchart::Rectangle { Class ::MDFC::CanvasFlowchart::Rectangle Version 1.2 Id md-flowchart-rectangle-b0202a04-60e9-41e9-b4b5-aca3736b804c 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-46ebc78a-aca7-4e73-aa08-1b917a007570} } md-flowchart-rectangle-cce6d1df-f93a-4a1d-97d4-cff90a91cca9 ::MDFC::CanvasFlowchart::Rectangle { Class ::MDFC::CanvasFlowchart::Rectangle Version 1.2 Id md-flowchart-rectangle-cce6d1df-f93a-4a1d-97d4-cff90a91cca9 Options {-height 120 -selected 0 -description {Temp: $T Time: 2000 ps Step: $tstep Control: Nose-Hoover Sampling: 10000 samples Trajectory: 0 frames} -fill LightBlue -x 105 -width 160 -y 407 -title NVT -stage md-lammps-stage-500bb802-d63d-443f-b595-5b205cda17b2} } } Connections { md-flowchart-oval-823917f3-c034-4aad-b4c4-672518f3a6b2,md-flowchart-rectangle-b0202a04-60e9-41e9-b4b5-aca3736b804c 76 md-flowchart-rectangle-b0202a04-60e9-41e9-b4b5-aca3736b804c,md-flowchart-rectangle-cce6d1df-f93a-4a1d-97d4-cff90a91cca9 70 md-flowchart-circle1-3ab37d25-fd1f-4750-b083-237344e1dc65,md-flowchart-oval-823917f3-c034-4aad-b4c4-672518f3a6b2 64 } } } } md-stage-variables-a1cc5d9a-aea8-4d1f-9bfe-34484a9df9e8 {} ::MD::Stage::Variables { Class ::MD::Stage::Variables Version 1.2 Id md-stage-variables-a1cc5d9a-aea8-4d1f-9bfe-34484a9df9e8 Options {-data {{tstep 0.2 fs} {T 300 K} {P 0 atm}} -stageid 1 -stdout stdout -master .flowchartDialog0 -debug 0 -iteration {} -stderr stderr -system {$system} -workingdirectory .} } md-stage-start-0bd7d8d1-7b2d-408a-8d60-a782d7a15fd3 {} ::MD::Stage::Start { Class ::MD::Stage::Start Version 1.2 Id md-stage-start-0bd7d8d1-7b2d-408a-8d60-a782d7a15fd3 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-start-0bd7d8d1-7b2d-408a-8d60-a782d7a15fd3,md-stage-variables-a1cc5d9a-aea8-4d1f-9bfe-34484a9df9e8 1 md-stage-variables-a1cc5d9a-aea8-4d1f-9bfe-34484a9df9e8,md-lammps-stage-e057e4bd-eca3-48f4-81fb-c826cd05f428 1 } ViewControl-canvas_flowchart { Class ::MDFC::CanvasFlowchart Version 1.2 Background #eff0f1 Steps { md-flowchart-rectangle-595b1074-ef8e-433c-b7de-df5c02a44de7 ::MDFC::CanvasFlowchart::Rectangle { Class ::MDFC::CanvasFlowchart::Rectangle Version 1.2 Id md-flowchart-rectangle-595b1074-ef8e-433c-b7de-df5c02a44de7 Options {-height 120 -selected 0 -description {} -fill #e6eb7a -x 110 -width 160 -y 244 -title LAMMPS -stage md-lammps-stage-e057e4bd-eca3-48f4-81fb-c826cd05f428} } md-flowchart-oval-7cd109d8-c7d0-4857-b505-5c76bf921e54 ::MDFC::CanvasFlowchart::Oval { Class ::MDFC::CanvasFlowchart::Oval Version 1.2 Id md-flowchart-oval-7cd109d8-c7d0-4857-b505-5c76bf921e54 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-a1cc5d9a-aea8-4d1f-9bfe-34484a9df9e8} } md-flowchart-circle1-70bb1e56-3fcb-435a-bc48-bec95f474245 ::MDFC::CanvasFlowchart::Circle1 { Class ::MDFC::CanvasFlowchart::Circle1 Version 1.2 Id md-flowchart-circle1-70bb1e56-3fcb-435a-bc48-bec95f474245 Options {-height 50 -selected 0 -description {} -fill #e6eb7a -x 110 -width 50 -y 14 -title Start -stage md-stage-start-0bd7d8d1-7b2d-408a-8d60-a782d7a15fd3} } } Connections { md-flowchart-oval-7cd109d8-c7d0-4857-b505-5c76bf921e54,md-flowchart-rectangle-595b1074-ef8e-433c-b7de-df5c02a44de7 56 md-flowchart-circle1-70bb1e56-3fcb-435a-bc48-bec95f474245,md-flowchart-oval-7cd109d8-c7d0-4857-b505-5c76bf921e54 60 } } } 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 WyckoffPosition int -1 @end @data 14 {} Si 0.0 {0.29760015828 0.471599757285 0.531426467132} Si1 1 -1 8 {} O 0.0 {0.301932385126 0.489254215633 0.528581370178} O1 2 -1 14 {} Si 0.0 {0.286501771962 0.498939662825 0.526040694282} Si2 3 -1 8 {} O 0.0 {0.28576545622 0.512648491557 0.538287870078} O2 4 -1 1 {} H 0.0 {0.288021059999 0.508915802314 0.547837425171} H1 5 -1 8 {} O 0.0 {0.286347977692 0.505904150907 0.509010131568} O3 6 -1 1 {} H 0.0 {0.294779601665 0.512012447364 0.507661400531} H2 7 -1 8 {} O 0.0 {0.271950319124 0.487922920647 0.528297573227} O4 8 -1 1 {} H 0.0 {0.272874720448 0.482743463347 0.537377500665} H3 9 -1 8 {} O 0.0 {0.285102704133 0.470451567715 0.544879636798} O5 10 -1 1 {} H 0.0 {0.276553670661 0.465526681467 0.541285348319} H4 11 -1 8 {} O 0.0 {0.312694606438 0.462262123629 0.536270425298} O6 12 -1 1 {} H 0.0 {0.311872388458 0.452338471906 0.532934008732} H5 13 -1 8 {} O 0.0 {0.290650238797 0.464433196703 0.515975246027} O7 14 -1 1 {} H 0.0 {0.293273681559 0.454287863058 0.515349189735} H6 15 -1 14 {} Si 0.0 {0.538463242295 0.511402571892 0.715350475248} Si1 16 -1 8 {} O 0.0 {0.545706152629 0.518473168569 0.70004420371} O1 17 -1 14 {} Si 0.0 {0.536241405968 0.51260046297 0.685404629205} Si2 18 -1 8 {} O 0.0 {0.518194920067 0.514156267419 0.688801204498} O2 19 -1 1 {} H 0.0 {0.515591483983 0.507851508485 0.696793432488} H1 20 -1 8 {} O 0.0 {0.540735080257 0.523021344617 0.670787171912} O3 21 -1 1 {} H 0.0 {0.550998242972 0.522103125914 0.668837380558} H2 22 -1 8 {} O 0.0 {0.540371428414 0.494937298663 0.681893562915} O4 23 -1 1 {} H 0.0 {0.532061177986 0.488899025198 0.684011848873} H3 24 -1 8 {} O 0.0 {0.522685358167 0.520025423952 0.719283952932} O5 25 -1 1 {} H 0.0 {0.515284842989 0.5129139807 0.72150823459} H4 26 -1 8 {} O 0.0 {0.550310712204 0.513613841767 0.729232450325} O6 27 -1 1 {} H 0.0 {0.559479824094 0.509147230111 0.726720906175} H5 28 -1 8 {} O 0.0 {0.535235396759 0.493489100055 0.712844934138} O7 29 -1 1 {} H 0.0 {0.543776136651 0.488963360272 0.708744858107} H6 30 -1 14 {} Si 0.0 {0.425973210794 0.510028491463 0.362921524071} Si1 31 -1 8 {} O 0.0 {0.417793998597 0.526418655905 0.361531581128} O1 32 -1 14 {} Si 0.0 {0.4304101547 0.53955649213 0.363942176705} Si2 33 -1 8 {} O 0.0 {0.447119147076 0.532594635571 0.360651326768} O2 34 -1 1 {} H 0.0 {0.453291058756 0.534257019817 0.368974230885} H1 35 -1 8 {} O 0.0 {0.427162322937 0.553450734554 0.352333375513} O3 36 -1 1 {} H 0.0 {0.418382012073 0.55150130078 0.346929894267} H2 37 -1 8 {} O 0.0 {0.429629451158 0.545694250306 0.381262512287} O4 38 -1 1 {} H 0.0 {0.43788820188 0.542048568696 0.386625413344} H3 39 -1 8 {} O 0.0 {0.444191940432 0.51222423536 0.361592999976} O5 40 -1 1 {} H 0.0 {0.449019706933 0.504866301949 0.367299447775} H4 41 -1 8 {} O 0.0 {0.420113211759 0.499048537298 0.349381497323} O6 42 -1 1 {} H 0.0 {0.416896918921 0.489919978685 0.353445065057} H5 43 -1 8 {} O 0.0 {0.421868402173 0.502472860032 0.379187179579} O7 44 -1 1 {} H 0.0 {0.429637208047 0.496040003092 0.382102353186} H6 45 -1 14 {} Si 0.0 {0.539324059611 0.25826703952 0.458414230996} Si1 46 -1 8 {} O 0.0 {0.527167581024 0.260061411936 0.444411510263} O1 47 -1 14 {} Si 0.0 {0.509580890732 0.259044431002 0.450347937869} Si2 48 -1 8 {} O 0.0 {0.498626422366 0.267287284277 0.437989719846} O2 49 -1 1 {} H 0.0 {0.503769180721 0.275285259073 0.433518497009} H1 50 -1 8 {} O 0.0 {0.508024501541 0.267651769183 0.466644645011} O4 51 -1 1 {} H 0.0 {0.51121478149 0.277622309102 0.465692279901} H3 52 -1 8 {} O 0.0 {0.533284120287 0.267170360045 0.473410080666} O6 53 -1 1 {} H 0.0 {0.539042858071 0.275841500635 0.474876642599} H5 54 -1 8 {} O 0.0 {0.555554932429 0.265363565107 0.453297175873} O7 55 -1 1 {} H 0.0 {0.557909464744 0.273533809897 0.45947202161} H6 56 -1 14 {} Si 0.0 {0.46067094043 0.686114907183 0.584607116264} Si1 57 -1 8 {} O 0.0 {0.458153488679 0.668765368273 0.579113306655} O1 58 -1 14 {} Si 0.0 {0.4627160935 0.667226817752 0.561375400566} Si2 59 -1 8 {} O 0.0 {0.479538953391 0.674171241183 0.558746399656} O2 60 -1 1 {} H 0.0 {0.482940342708 0.678558425953 0.567641751156} H1 61 -1 8 {} O 0.0 {0.46254927016 0.649456698555 0.556598597999} O3 62 -1 1 {} H 0.0 {0.454534847199 0.647676030297 0.55004392837} H2 63 -1 8 {} O 0.0 {0.450615272296 0.676493081913 0.551060396346} O4 64 -1 1 {} H 0.0 {0.454865934364 0.678522423194 0.541667239871} H3 65 -1 8 {} O 0.0 {0.476869661804 0.687517933789 0.593232439342} O5 66 -1 1 {} H 0.0 {0.477714907243 0.679844108982 0.600331547677} H4 67 -1 8 {} O 0.0 {0.447182305435 0.690919787281 0.596150647053} O6 68 -1 1 {} H 0.0 {0.444231786542 0.700786742843 0.594156468362} H5 69 -1 8 {} O 0.0 {0.460477291974 0.697281729331 0.569971766791} O7 70 -1 1 {} H 0.0 {0.450782475476 0.701095931977 0.56862326295} H6 71 -1 14 {} Si 0.0 {0.602695762246 0.393494523323 0.669090873598} Si1 72 -1 8 {} O 0.0 {0.590689646426 0.407252747737 0.666666818475} O1 73 -1 14 {} Si 0.0 {0.591965897886 0.41367921511 0.649447302737} Si2 74 -1 8 {} O 0.0 {0.608524863738 0.421280320533 0.646940869808} O2 75 -1 1 {} H 0.0 {0.6138414009 0.421128187463 0.65598666206} H1 76 -1 8 {} O 0.0 {0.589682435896 0.399859978315 0.637524548927} O3 77 -1 1 {} H 0.0 {0.593336248898 0.390973237485 0.641733719519} H2 78 -1 8 {} O 0.0 {0.578939096867 0.426366066956 0.646687974214} O4 79 -1 1 {} H 0.0 {0.581185138491 0.434955650561 0.652291748354} H3 80 -1 8 {} O 0.0 {0.599866089042 0.380525335224 0.656368890344} O5 81 -1 1 {} H 0.0 {0.608590571959 0.379288279953 0.650657165212} H4 82 -1 8 {} O 0.0 {0.60035604305 0.386243703383 0.685844121413} O6 83 -1 1 {} H 0.0 {0.604752693054 0.376723277138 0.686178900721} H5 84 -1 8 {} O 0.0 {0.6198569952 0.399936642167 0.66753053057} O7 85 -1 1 {} H 0.0 {0.626297515558 0.394204560597 0.673527814568} H6 86 -1 8 {} O 0.0 {0.388563013099 0.703414171194 0.536046899004} O1 87 -1 14 {} Si 0.0 {0.385862058694 0.698387611951 0.517987318823} Si2 88 -1 8 {} O 0.0 {0.368262950154 0.692775100647 0.516329417905} O2 89 -1 1 {} H 0.0 {0.363087234802 0.694829364249 0.525252775284} H1 90 -1 8 {} O 0.0 {0.389627152664 0.712127150439 0.506011610768} O3 91 -1 1 {} H 0.0 {0.399777163905 0.711924449083 0.50350205828} H2 92 -1 8 {} O 0.0 {0.396743811393 0.684099216074 0.513943403388} O4 93 -1 1 {} H 0.0 {0.39081556461 0.67574338074 0.511655977261} H3 94 -1 8 {} O 0.0 {0.412776062951 0.715998507628 0.549176020394} O5 95 -1 8 {} O 0.0 {0.33762029715 0.458990436586 0.310313827191} O4 96 -1 1 {} H 0.0 {0.337700173686 0.469344524825 0.308549542374} H3 97 -1 14 {} Si 0.0 {0.498973640288 0.387187372452 0.657289030732} Si1 98 -1 8 {} O 0.0 {0.507686833314 0.380228204923 0.672145243282} O1 99 -1 14 {} Si 0.0 {0.523391728489 0.389546256358 0.675509427773} Si2 100 -1 8 {} O 0.0 {0.52025756856 0.407671649023 0.674317376963} O2 101 -1 1 {} H 0.0 {0.522696384977 0.411011975913 0.664653740677} H1 102 -1 8 {} O 0.0 {0.529412345891 0.385494972204 0.69242552825} O3 103 -1 1 {} H 0.0 {0.537806654705 0.379228695412 0.691727904372} H2 104 -1 8 {} O 0.0 {0.536186511608 0.384773474673 0.663197665455} O4 105 -1 1 {} H 0.0 {0.544492706599 0.391149300667 0.664147266489} H3 106 -1 8 {} O 0.0 {0.485898003901 0.375425111755 0.65177796745} O5 107 -1 1 {} H 0.0 {0.476794220937 0.380556584441 0.650744963176} H4 108 -1 8 {} O 0.0 {0.511020879629 0.389833196299 0.643609197253} O6 109 -1 1 {} H 0.0 {0.505797867824 0.391627009196 0.63465735551} H5 110 -1 8 {} O 0.0 {0.49112906378 0.403163076582 0.661614846801} O7 111 -1 1 {} H 0.0 {0.483450546588 0.405248823443 0.65472653398} H6 112 -1 8 {} O 0.0 {0.62772860407 0.644131264653 0.612754415046} O6 113 -1 1 {} H 0.0 {0.635158917753 0.63693665179 0.614583740132} H5 114 -1 14 {} Si 0.0 {0.377623161824 0.507365523546 0.539157858313} Si1 115 -1 8 {} O 0.0 {0.383550162229 0.521661339698 0.549146042265} O1 116 -1 14 {} Si 0.0 {0.398288698963 0.529032238618 0.540970863225} Si2 117 -1 8 {} O 0.0 {0.395841001899 0.528800447048 0.522752927753} O2 118 -1 1 {} H 0.0 {0.385584851808 0.527954035863 0.520630683851} H1 119 -1 8 {} O 0.0 {0.400460859315 0.546400669575 0.546649446848} O3 120 -1 1 {} H 0.0 {0.403245615603 0.546443019106 0.556771087773} H2 121 -1 8 {} O 0.0 {0.413261158233 0.519241209376 0.545302759318} O4 122 -1 1 {} H 0.0 {0.410347338045 0.510148262833 0.549674214062} H3 123 -1 8 {} O 0.0 {0.362224532379 0.512004339492 0.530188948599} O5 124 -1 1 {} H 0.0 {0.364515742642 0.514012967474 0.520138068553} H4 125 -1 8 {} O 0.0 {0.374156982454 0.493134745521 0.55028061791} O6 126 -1 1 {} H 0.0 {0.381436730803 0.492762219264 0.557830365712} H5 127 -1 8 {} O 0.0 {0.390581250022 0.50263336914 0.526999048734} O7 128 -1 1 {} H 0.0 {0.398911840447 0.498794907202 0.532100975448} H6 129 -1 14 {} Si 0.0 {0.425760499928 0.292751654489 0.598478045125} Si1 130 -1 8 {} O 0.0 {0.439143819145 0.300575176426 0.608309462684} O1 131 -1 14 {} Si 0.0 {0.431602536049 0.312327230293 0.62022307331} Si2 132 -1 8 {} O 0.0 {0.44212880581 0.313450786182 0.635251014743} O2 133 -1 1 {} H 0.0 {0.442921405336 0.30395482862 0.639650099805} H1 134 -1 8 {} O 0.0 {0.430228455363 0.328904174633 0.612386862942} O3 135 -1 1 {} H 0.0 {0.433546364029 0.328339554083 0.602438171615} H2 136 -1 8 {} O 0.0 {0.414847896799 0.306332005675 0.624897488681} O4 137 -1 1 {} H 0.0 {0.41551801561 0.300571172033 0.633648990078} H3 138 -1 8 {} O 0.0 {0.416792085464 0.305708945368 0.588985986049} O5 139 -1 1 {} H 0.0 {0.421535846051 0.307180459488 0.579740497372} H4 140 -1 8 {} O 0.0 {0.414057978075 0.28425322419 0.6098354433} O6 141 -1 8 {} O 0.0 {0.433024830748 0.280503800648 0.5868411061} O7 142 -1 1 {} H 0.0 {0.439303452049 0.273968818061 0.592135903461} H6 143 -1 14 {} Si 0.0 {0.495084962093 0.406839156643 0.328327386814} Si1 144 -1 8 {} O 0.0 {0.493791189276 0.414502283558 0.344987316299} O1 145 -1 14 {} Si 0.0 {0.497675689363 0.401870435022 0.357766984855} Si2 146 -1 8 {} O 0.0 {0.51393116855 0.394127833039 0.353969673525} O2 147 -1 1 {} H 0.0 {0.51237895943 0.384611814758 0.3498124921} H1 148 -1 8 {} O 0.0 {0.498387881026 0.409858080161 0.374314006435} O3 149 -1 1 {} H 0.0 {0.501886298861 0.419694672372 0.373286025593} H2 150 -1 8 {} O 0.0 {0.48458917562 0.388966630081 0.357782050911} O4 151 -1 1 {} H 0.0 {0.475390391926 0.393323924728 0.35519447809} H3 152 -1 8 {} O 0.0 {0.498752146685 0.388901762918 0.330092809258} O5 153 -1 1 {} H 0.0 {0.494102195582 0.383609834452 0.322317503729} H4 154 -1 8 {} O 0.0 {0.508589078726 0.414893772971 0.31888917102} O6 155 -1 1 {} H 0.0 {0.507110750647 0.413229731268 0.308627744129} H5 156 -1 8 {} O 0.0 {0.479203693658 0.409016719258 0.319308839405} O7 157 -1 1 {} H 0.0 {0.477586542886 0.419239875755 0.317528387799} H6 158 -1 14 {} Si 0.0 {0.343294192169 0.672428359121 0.5413751171} Si1 159 -1 8 {} O 0.0 {0.361382531429 0.672266283566 0.537547353189} O1 160 -1 14 {} Si 0.0 {0.371166095681 0.677695312189 0.552242617634} Si2 161 -1 8 {} O 0.0 {0.385150828292 0.688174183355 0.546741293673} O2 162 -1 1 {} H 0.0 {0.39357600418 0.682111634467 0.545197317647} H1 163 -1 8 {} O 0.0 {0.377930583252 0.662928705207 0.560917535258} O4 164 -1 1 {} H 0.0 {0.388402993206 0.663590477597 0.56129812189} H3 165 -1 8 {} O 0.0 {0.336410207989 0.65532051276 0.539303468501} O7 166 -1 1 {} H 0.0 {0.331827821271 0.652159517657 0.5482728166} H6 167 -1 14 {} Si 0.0 {0.33378062597 0.597666296357 0.489429069214} Si1 168 -1 8 {} O 0.0 {0.317225268297 0.605626044801 0.488118736517} O1 169 -1 14 {} Si 0.0 {0.319078830013 0.622968050052 0.482167565434} Si2 170 -1 8 {} O 0.0 {0.30524574937 0.627014080375 0.470730128027} O2 171 -1 1 {} H 0.0 {0.306515703235 0.621762346155 0.461726934341} H1 172 -1 8 {} O 0.0 {0.318690805937 0.634471192052 0.496529959442} O3 173 -1 1 {} H 0.0 {0.325886916568 0.631505621246 0.50357292276} H2 174 -1 8 {} O 0.0 {0.33508082873 0.62479142401 0.473277338207} O4 175 -1 1 {} H 0.0 {0.334043163167 0.631972078196 0.465674508145} H3 176 -1 8 {} O 0.0 {0.341537232464 0.602229034137 0.505475728991} O5 177 -1 1 {} H 0.0 {0.334571576129 0.600881969169 0.513218391576} H4 178 -1 8 {} O 0.0 {0.34447994854 0.603373255867 0.475590183111} O6 179 -1 1 {} H 0.0 {0.342946953647 0.597205835289 0.467228754417} H5 180 -1 8 {} O 0.0 {0.331868021577 0.579389608816 0.488549560632} O7 181 -1 1 {} H 0.0 {0.336879110137 0.575761883939 0.480064684463} H6 182 -1 14 {} Si 0.0 {0.329849067432 0.531551689707 0.337364662076} Si1 183 -1 8 {} O 0.0 {0.320364928039 0.541960203996 0.34917510761} O1 184 -1 14 {} Si 0.0 {0.3183847509 0.532890301942 0.365048715363} Si2 185 -1 8 {} O 0.0 {0.333805210309 0.523615329745 0.368736471509} O2 186 -1 1 {} H 0.0 {0.33997462021 0.523592278997 0.360238763031} H1 187 -1 8 {} O 0.0 {0.315010099356 0.544881841668 0.378573878189} O3 188 -1 1 {} H 0.0 {0.309120676457 0.552744283666 0.374867412699} H2 189 -1 8 {} O 0.0 {0.304380050173 0.521079168789 0.363695699078} O4 190 -1 1 {} H 0.0 {0.308051246882 0.511266218099 0.364369631582} H3 191 -1 8 {} O 0.0 {0.330871289056 0.514322913636 0.343865347591} O6 192 -1 1 {} H 0.0 {0.340856564404 0.511116162015 0.34375035763} H5 193 -1 8 {} O 0.0 {0.346779431969 0.538383310803 0.335387283226} O7 194 -1 1 {} H 0.0 {0.347670897806 0.547154620177 0.341074366938} H6 195 -1 8 {} O 0.0 {0.533919571091 0.257129650785 0.511470500887} O4 196 -1 1 {} H 0.0 {0.537055992334 0.262423939931 0.50296039495} H3 197 -1 14 {} Si 0.0 {0.519994516101 0.324133607208 0.488670910184} Si1 198 -1 8 {} O 0.0 {0.512264959159 0.34084470151 0.490066489618} O1 199 -1 14 {} Si 0.0 {0.493990459738 0.339369772174 0.492173324025} Si2 200 -1 8 {} O 0.0 {0.488403850885 0.351221201314 0.505099578458} O2 201 -1 1 {} H 0.0 {0.4967804673 0.355170921507 0.51005128696} H1 202 -1 8 {} O 0.0 {0.485613675355 0.343360330743 0.476264174037} O3 203 -1 1 {} H 0.0 {0.48940463983 0.337177618942 0.468677819852} H2 204 -1 8 {} O 0.0 {0.489607058617 0.322264621632 0.497310693911} O4 205 -1 1 {} H 0.0 {0.48208216192 0.322647530292 0.504649233186} H3 206 -1 8 {} O 0.0 {0.537823216475 0.326051588236 0.484536934167} O5 207 -1 1 {} H 0.0 {0.543160159732 0.317774726742 0.488174211425} H4 208 -1 8 {} O 0.0 {0.511665704461 0.31450756842 0.475377185815} O6 209 -1 1 {} H 0.0 {0.501493719955 0.31343152817 0.477686762026} H5 210 -1 8 {} O 0.0 {0.518414593016 0.315199452958 0.504675855982} O7 211 -1 1 {} H 0.0 {0.521483028367 0.305223095638 0.503423648222} H6 212 -1 14 {} Si 0.0 {0.561670534201 0.672129445918 0.357392428552} Si1 213 -1 8 {} O 0.0 {0.55902240081 0.663465307767 0.373401771751} O1 214 -1 14 {} Si 0.0 {0.572674551996 0.667692320542 0.38499579335} Si2 215 -1 8 {} O 0.0 {0.565817885359 0.676757853737 0.399444396836} O2 216 -1 1 {} H 0.0 {0.557240424767 0.682025457485 0.396489521089} H1 217 -1 8 {} O 0.0 {0.5808177802 0.652244362259 0.390783092175} O3 218 -1 1 {} H 0.0 {0.590350260272 0.65149699982 0.386452045996} H2 219 -1 8 {} O 0.0 {0.585019149059 0.678287123734 0.376385097396} O4 220 -1 1 {} H 0.0 {0.590528810018 0.683713733539 0.383492197486} H3 221 -1 8 {} O 0.0 {0.547530426158 0.668654461874 0.34612377538} O5 222 -1 1 {} H 0.0 {0.542043269636 0.677478718215 0.344580043767} H4 223 -1 8 {} O 0.0 {0.577281821069 0.66613701605 0.349714607281} O6 224 -1 1 {} H 0.0 {0.580426243044 0.657383928631 0.354576404745} H5 225 -1 14 {} Si 0.0 {0.359651024819 0.484295767659 0.490959086089} Si1 226 -1 8 {} O 0.0 {0.362916164084 0.466747887666 0.486417838405} O1 227 -1 14 {} Si 0.0 {0.348645770683 0.456261102446 0.491466495007} Si2 228 -1 8 {} O 0.0 {0.353553232704 0.438535658688 0.490837488982} O2 229 -1 1 {} H 0.0 {0.353677253091 0.435304822641 0.480846044782} H1 230 -1 8 {} O 0.0 {0.343568241727 0.46059354405 0.508620430427} O3 231 -1 1 {} H 0.0 {0.344482877077 0.470955256917 0.510016695742} H2 232 -1 8 {} O 0.0 {0.334543614049 0.459114565308 0.479992843897} O4 233 -1 1 {} H 0.0 {0.336171834149 0.467974094377 0.474603397656} H3 234 -1 8 {} O 0.0 {0.364796477831 0.487180879497 0.5083931585} O5 235 -1 1 {} H 0.0 {0.37304888263 0.493682527059 0.508552162854} H4 236 -1 8 {} O 0.0 {0.341677401951 0.487860740866 0.489200871801} O6 237 -1 1 {} H 0.0 {0.340090295198 0.493523057495 0.480496089422} H5 238 -1 8 {} O 0.0 {0.36921811799 0.495389505859 0.479836445757} O7 239 -1 1 {} H 0.0 {0.366887459805 0.493172279066 0.469841770418} H6 240 -1 14 {} Si 0.0 {0.551635738197 0.452331965687 0.314883914872} Si1 241 -1 8 {} O 0.0 {0.55824061202 0.435590107076 0.311038168793} O1 242 -1 14 {} Si 0.0 {0.545327624714 0.422929950224 0.314348839663} Si2 243 -1 8 {} O 0.0 {0.534129184464 0.428876589304 0.327685812842} O2 244 -1 1 {} H 0.0 {0.539799530436 0.43364103947 0.335131474774} H1 245 -1 8 {} O 0.0 {0.53562093476 0.419928594387 0.298989981881} O3 246 -1 1 {} H 0.0 {0.539338738647 0.425981724251 0.291266436079} H2 247 -1 8 {} O 0.0 {0.553374852859 0.407291303704 0.319677447811} O4 248 -1 1 {} H 0.0 {0.551546149121 0.405721437887 0.329880452595} H3 249 -1 8 {} O 0.0 {0.563962014873 0.46503577279 0.309889090175} O5 250 -1 1 {} H 0.0 {0.564087816083 0.465850956434 0.299429097162} H4 251 -1 8 {} O 0.0 {0.548428553006 0.453688472979 0.332936943355} O6 252 -1 1 {} H 0.0 {0.545209323246 0.463431130333 0.335171533917} H5 253 -1 8 {} O 0.0 {0.53595189967 0.455063438002 0.305673784948} O7 254 -1 1 {} H 0.0 {0.537056754947 0.46332521756 0.299285742414} H6 255 -1 14 {} Si 0.0 {0.471295948937 0.516969985211 0.340986722911} Si1 256 -1 8 {} O 0.0 {0.486530978587 0.516408291442 0.330666268406} O1 257 -1 14 {} Si 0.0 {0.501178195412 0.520560461219 0.341035000596} Si2 258 -1 8 {} O 0.0 {0.512817836588 0.53097534539 0.331306631654} O2 259 -1 1 {} H 0.0 {0.522695742615 0.528486169094 0.333862948412} H1 260 -1 8 {} O 0.0 {0.495744066102 0.529799543528 0.355997246128} O3 261 -1 1 {} H 0.0 {0.485638876902 0.527721756599 0.35790679309} H2 262 -1 8 {} O 0.0 {0.509661253777 0.505056540382 0.346143149111} O4 263 -1 1 {} H 0.0 {0.519487400348 0.505075344474 0.342436619835} H3 264 -1 8 {} O 0.0 {0.475470820002 0.512663102203 0.358374138475} O5 265 -1 1 {} H 0.0 {0.466849984336 0.513433605986 0.364319591322} H4 266 -1 8 {} O 0.0 {0.459003789232 0.504916741835 0.334476172468} O6 267 -1 1 {} H 0.0 {0.463070422027 0.499908255847 0.326197488527} H5 268 -1 8 {} O 0.0 {0.464131162592 0.533887170876 0.34041351457} O7 269 -1 1 {} H 0.0 {0.454220681185 0.533339513412 0.337003114105} H6 270 -1 8 {} O 0.0 {0.324308716947 0.565091028789 0.333665699037} O2 271 -1 1 {} H 0.0 {0.330072626159 0.572563829576 0.338270493724} H1 272 -1 14 {} Si 0.0 {0.576875697366 0.693362955 0.581616974781} Si1 273 -1 8 {} O 0.0 {0.563315504878 0.69875778455 0.57040048888} O1 274 -1 14 {} Si 0.0 {0.569561169529 0.699543831383 0.553109716085} Si2 275 -1 8 {} O 0.0 {0.584074817799 0.710811862061 0.552320298013} O2 276 -1 8 {} O 0.0 {0.574567821442 0.682728855265 0.547627592125} O3 277 -1 1 {} H 0.0 {0.575196194786 0.682524293479 0.537154567059} H2 278 -1 8 {} O 0.0 {0.556282126458 0.705872011657 0.542058987455} O4 279 -1 1 {} H 0.0 {0.555838919677 0.716339622641 0.542767080006} H3 280 -1 8 {} O 0.0 {0.569635561063 0.686605662313 0.597137299273} O5 281 -1 1 {} H 0.0 {0.560508488665 0.681896164693 0.594987256517} H4 282 -1 8 {} O 0.0 {0.586936333179 0.680371151343 0.573369749604} O7 283 -1 1 {} H 0.0 {0.59685956397 0.683693339078 0.572486569075} H6 284 -1 14 {} Si 0.0 {0.555191434149 0.505076219335 0.672759942675} Si1 285 -1 8 {} O 0.0 {0.541024461996 0.509419650738 0.66144730705} O1 286 -1 14 {} Si 0.0 {0.525964963328 0.514819372973 0.670866677747} Si2 287 -1 8 {} O 0.0 {0.518738795786 0.500348106898 0.679657098963} O2 288 -1 1 {} H 0.0 {0.518355789979 0.492151067153 0.673119893728} H1 289 -1 8 {} O 0.0 {0.530451074342 0.527964174551 0.683106704139} O3 290 -1 1 {} H 0.0 {0.531846426543 0.537070132667 0.678096796411} H2 291 -1 8 {} O 0.0 {0.513576078142 0.521618168757 0.659105034582} O4 292 -1 1 {} H 0.0 {0.504341763714 0.516881387403 0.660632635617} H3 293 -1 8 {} O 0.0 {0.549755581409 0.504568476539 0.69036219758} O5 294 -1 1 {} H 0.0 {0.552975935984 0.495577128361 0.694749196475} H4 295 -1 8 {} O 0.0 {0.568510771644 0.517645316767 0.67093359214} O6 296 -1 1 {} H 0.0 {0.577743777994 0.513340372062 0.67350214354} H5 297 -1 8 {} O 0.0 {0.56181112791 0.488572948226 0.668050414743} O7 298 -1 1 {} H 0.0 {0.569912546857 0.486155789791 0.674274688687} H6 299 -1 14 {} Si 0.0 {0.58853480896 0.545084636408 0.61417090643} Si1 300 -1 8 {} O 0.0 {0.596234087767 0.548622820338 0.630556482551} O1 301 -1 14 {} Si 0.0 {0.613921938644 0.543425392005 0.630476759498} Si2 302 -1 8 {} O 0.0 {0.62392762561 0.555646237257 0.639939525558} O2 303 -1 1 {} H 0.0 {0.625231738336 0.564314577533 0.634164403267} H1 304 -1 8 {} O 0.0 {0.615509769133 0.526866377109 0.638352666446} O3 305 -1 1 {} H 0.0 {0.606558905134 0.521534222781 0.637108256148} H2 306 -1 8 {} O 0.0 {0.620044737238 0.542588676538 0.613151444683} O4 307 -1 1 {} H 0.0 {0.624382468256 0.551786039294 0.610539734993} H3 308 -1 8 {} O 0.0 {0.570467144335 0.548449521948 0.6150915282} O5 309 -1 1 {} H 0.0 {0.568768588363 0.558736106945 0.613820888541} H4 310 -1 8 {} O 0.0 {0.591230541296 0.527420999006 0.609739582163} O6 311 -1 1 {} H 0.0 {0.60152834365 0.525430220255 0.609427595714} H5 312 -1 8 {} O 0.0 {0.59607708072 0.555881774961 0.601310046807} O7 313 -1 1 {} H 0.0 {0.606505350491 0.555882398625 0.602424277454} H6 314 -1 14 {} Si 0.0 {0.551847697216 0.623372670758 0.677087501832} Si2 315 -1 8 {} O 0.0 {0.553609176082 0.605102581404 0.678362898759} O2 316 -1 1 {} H 0.0 {0.563527359958 0.602403341162 0.676254158286} H1 317 -1 8 {} O 0.0 {0.534694967145 0.628191599051 0.681755934307} O3 318 -1 1 {} H 0.0 {0.528756631644 0.62877387018 0.673117013512} H2 319 -1 8 {} O 0.0 {0.555220060282 0.628688396757 0.659834515832} O4 320 -1 1 {} H 0.0 {0.564622953015 0.633316288032 0.659389139054} H3 321 -1 8 {} O 0.0 {0.580198311118 0.624653279798 0.664209001202} O6 322 -1 1 {} H 0.0 {0.58438066666 0.630728747821 0.656727448146} H5 323 -1 8 {} O 0.0 {0.59082017657 0.271538560974 0.470726467183} O1 324 -1 14 {} Si 0.0 {0.604065809239 0.280843089332 0.461941124051} Si2 325 -1 8 {} O 0.0 {0.620516717578 0.27413712938 0.466742131833} O2 326 -1 1 {} H 0.0 {0.624546463054 0.279986281446 0.474475167347} H1 327 -1 8 {} O 0.0 {0.601789948581 0.279061261652 0.443768312213} O3 328 -1 1 {} H 0.0 {0.592394343114 0.274791537657 0.441835291866} H2 329 -1 8 {} O 0.0 {0.60313637453 0.298646272631 0.466507115304} O4 330 -1 1 {} H 0.0 {0.597920624497 0.299656221563 0.47556190402} H3 331 -1 8 {} O 0.0 {0.610649304129 0.267590914495 0.492961424754} O6 332 -1 14 {} Si 0.0 {0.655684215389 0.357696988142 0.446201694499} Si1 333 -1 8 {} O 0.0 {0.667655829582 0.369592448702 0.439017162585} O1 334 -1 14 {} Si 0.0 {0.664832442145 0.370462976701 0.420915062138} Si2 335 -1 8 {} O 0.0 {0.663215103117 0.353396855128 0.414235484984} O2 336 -1 1 {} H 0.0 {0.670920608752 0.347395502778 0.418117878457} H1 337 -1 8 {} O 0.0 {0.649355186535 0.379851304884 0.417610720259} O3 338 -1 1 {} H 0.0 {0.647104306768 0.385890170687 0.425911161751} H2 339 -1 8 {} O 0.0 {0.679017226116 0.378906033329 0.412830626155} O4 340 -1 1 {} H 0.0 {0.687637756131 0.3730129087 0.413893760556} H3 341 -1 8 {} O 0.0 {0.657425913516 0.341451825905 0.437715836927} O5 342 -1 1 {} H 0.0 {0.661252403552 0.334381919216 0.444459549681} H4 343 -1 8 {} O 0.0 {0.638615220847 0.364081111271 0.443764863943} O6 344 -1 1 {} H 0.0 {0.63886786893 0.374553388893 0.44315496714} H5 345 -1 8 {} O 0.0 {0.658962314464 0.355666070769 0.464165250109} O7 346 -1 1 {} H 0.0 {0.650068927939 0.352947666602 0.469036829768} H6 347 -1 14 {} Si 0.0 {0.670273765585 0.457226752054 0.611632178847} Si1 348 -1 8 {} O 0.0 {0.657106183496 0.448157726185 0.620842073411} O1 349 -1 14 {} Si 0.0 {0.660900658396 0.447862606349 0.6388811928} Si2 350 -1 8 {} O 0.0 {0.66405951129 0.430499856427 0.644232434214} O2 351 -1 1 {} H 0.0 {0.657221932995 0.424074942551 0.639484279991} H1 352 -1 8 {} O 0.0 {0.675783843644 0.45809561802 0.642333063847} O3 353 -1 1 {} H 0.0 {0.674597438863 0.462973866092 0.651548345405} H2 354 -1 8 {} O 0.0 {0.646534591251 0.454613332481 0.648148360854} O4 355 -1 1 {} H 0.0 {0.637801806061 0.453296854341 0.642445578477} H3 356 -1 8 {} O 0.0 {0.665634141149 0.458271780913 0.593877111688} O5 357 -1 1 {} H 0.0 {0.663012886829 0.468145453466 0.591542063661} H4 358 -1 8 {} O 0.0 {0.68627904294 0.448291915664 0.61318495391} O6 359 -1 1 {} H 0.0 {0.693169792009 0.452253636633 0.606289869015} H5 360 -1 8 {} O 0.0 {0.672027329369 0.474197991018 0.618496908594} O7 361 -1 1 {} H 0.0 {0.679772306708 0.479201592508 0.61347727355} H6 362 -1 14 {} Si 0.0 {0.480457428696 0.618641067601 0.326299974822} Si1 363 -1 8 {} O 0.0 {0.465431043517 0.614090181957 0.316756721364} O1 364 -1 14 {} Si 0.0 {0.464130222836 0.59572015026 0.316077824603} Si2 365 -1 8 {} O 0.0 {0.458658730175 0.589397589698 0.332472952849} O2 366 -1 1 {} H 0.0 {0.463747847947 0.594560063429 0.340083029258} H1 367 -1 8 {} O 0.0 {0.451942745669 0.590825592868 0.303177239157} O3 368 -1 1 {} H 0.0 {0.452242670012 0.597734459861 0.295293449931} H2 369 -1 8 {} O 0.0 {0.480506810324 0.588546457458 0.311941914655} O4 370 -1 1 {} H 0.0 {0.48102824866 0.57871808721 0.315599430867} H3 371 -1 8 {} O 0.0 {0.4756714585 0.624572673758 0.343068351127} O5 372 -1 1 {} H 0.0 {0.465306227827 0.626180233475 0.343384152844} H4 373 -1 8 {} O 0.0 {0.489690241798 0.631826975123 0.317488263779} O6 374 -1 1 {} H 0.0 {0.499461266583 0.628492377733 0.315540231045} H5 375 -1 8 {} O 0.0 {0.491177133531 0.603916359268 0.327858486863} O7 376 -1 1 {} H 0.0 {0.500764503648 0.606219702047 0.324279827139} H6 377 -1 14 {} Si 0.0 {0.514140716297 0.429396286323 0.562211793161} Si1 378 -1 8 {} O 0.0 {0.496776844393 0.425225424388 0.557776639224} O1 379 -1 14 {} Si 0.0 {0.491815948043 0.434882479106 0.542914521026} Si2 380 -1 8 {} O 0.0 {0.483633232779 0.450504810548 0.548183333292} O2 381 -1 1 {} H 0.0 {0.473510481779 0.450253202843 0.545403207091} H1 382 -1 8 {} O 0.0 {0.506748693235 0.438847074184 0.532935200816} O3 383 -1 1 {} H 0.0 {0.512249609181 0.430060584316 0.531253866275} H2 384 -1 8 {} O 0.0 {0.48013416734 0.424957496581 0.532748151717} O4 385 -1 1 {} H 0.0 {0.484114768759 0.42368685575 0.523111958913} H3 386 -1 8 {} O 0.0 {0.523815147572 0.432364560034 0.546860360873} O5 387 -1 1 {} H 0.0 {0.521303512657 0.441770698997 0.542927970434} H4 388 -1 8 {} O 0.0 {0.521632176566 0.415443321825 0.571582898027} O6 389 -1 1 {} H 0.0 {0.514072344951 0.408830127689 0.574632444871} H5 390 -1 8 {} O 0.0 {0.514346704102 0.444576085859 0.572601416493} O7 391 -1 1 {} H 0.0 {0.507367729338 0.443573675218 0.580378154371} H6 392 -1 14 {} Si 0.0 {0.523254741505 0.447368924565 0.290273439352} Si1 393 -1 8 {} O 0.0 {0.515344972617 0.448895243279 0.306841958651} O1 394 -1 14 {} Si 0.0 {0.509363949941 0.432420904364 0.312395444522} Si2 395 -1 8 {} O 0.0 {0.493160211122 0.428769494757 0.304465212347} O2 396 -1 1 {} H 0.0 {0.489342330512 0.437538028923 0.300131168798} H1 397 -1 8 {} O 0.0 {0.521592560825 0.419543057747 0.307600399079} O3 398 -1 1 {} H 0.0 {0.526579653257 0.41609858282 0.316174506326} H2 399 -1 8 {} O 0.0 {0.507362484959 0.432443929932 0.330698391012} O4 400 -1 1 {} H 0.0 {0.497819759099 0.436065932838 0.333166522897} H3 401 -1 8 {} O 0.0 {0.517044792472 0.432244429946 0.281842817907} O5 402 -1 1 {} H 0.0 {0.517299974528 0.42417027819 0.288539152059} H4 403 -1 8 {} O 0.0 {0.541525546912 0.446218162954 0.292241129712} O6 404 -1 1 {} H 0.0 {0.545828171246 0.443128768447 0.283184608607} H5 405 -1 8 {} O 0.0 {0.519095611374 0.462161071048 0.280143116884} O7 406 -1 1 {} H 0.0 {0.527779909739 0.467833362701 0.278521311025} H6 407 -1 8 {} O 0.0 {0.628511870205 0.399892689348 0.310655588631} O1 408 -1 8 {} O 0.0 {0.621259697544 0.371242227753 0.316044864557} O3 409 -1 1 {} H 0.0 {0.620990897714 0.376069237836 0.325364208622} H2 410 -1 8 {} O 0.0 {0.624444936774 0.426961247367 0.298308565096} O6 411 -1 1 {} H 0.0 {0.614278045072 0.424378597632 0.298703830587} H5 412 -1 8 {} O 0.0 {0.70368522111 0.563402475452 0.607177392156} O4 413 -1 1 {} H 0.0 {0.706463010615 0.562899001375 0.597067989369} H3 414 -1 14 {} Si 0.0 {0.639018814624 0.418667489354 0.657741988005} Si1 415 -1 8 {} O 0.0 {0.650612995172 0.432462128445 0.654294736547} O1 416 -1 14 {} Si 0.0 {0.661734756427 0.434710677736 0.668722038843} Si2 417 -1 8 {} O 0.0 {0.652564271726 0.443221383557 0.682218468534} O3 418 -1 1 {} H 0.0 {0.643542923661 0.447040192361 0.678429522619} H2 419 -1 8 {} O 0.0 {0.630034215844 0.422073864962 0.673429782009} O5 420 -1 1 {} H 0.0 {0.623844552933 0.413939269307 0.675746246529} H4 421 -1 8 {} O 0.0 {0.648483991222 0.402967125168 0.659349448612} O6 422 -1 1 {} H 0.0 {0.657635079972 0.403876781249 0.654275188365} H5 423 -1 8 {} O 0.0 {0.626976526313 0.417193449043 0.643926274826} O7 424 -1 1 {} H 0.0 {0.627992411713 0.407775793907 0.639408279067} H6 425 -1 14 {} Si 0.0 {0.549058207422 0.555972639173 0.721359148239} Si1 426 -1 8 {} O 0.0 {0.531053710523 0.558380757204 0.71887498177} O1 427 -1 8 {} O 0.0 {0.526008379519 0.58792732093 0.717898170368} O3 428 -1 1 {} H 0.0 {0.534189523155 0.587413727516 0.711336389894} H2 429 -1 8 {} O 0.0 {0.55667137184 0.549906815096 0.705779478132} O7 430 -1 1 {} H 0.0 {0.551856122219 0.554358520792 0.697591614742} H6 431 -1 14 {} Si 0.0 {0.338913473084 0.598717954657 0.568525557289} Si1 432 -1 8 {} O 0.0 {0.333418302967 0.614012120522 0.559843029261} O1 433 -1 14 {} Si 0.0 {0.327220350112 0.60978966788 0.543007147775} Si2 434 -1 8 {} O 0.0 {0.341484019847 0.607423842368 0.531619318043} O2 435 -1 1 {} H 0.0 {0.348981251246 0.601939500378 0.536507062915} H1 436 -1 8 {} O 0.0 {0.317318052258 0.594303117665 0.543747379969} O3 437 -1 1 {} H 0.0 {0.312501041507 0.593673335972 0.553042277851} H2 438 -1 8 {} O 0.0 {0.316636083797 0.623496290271 0.536787737029} O4 439 -1 1 {} H 0.0 {0.315228778226 0.622408516626 0.526443582645} H3 440 -1 8 {} O 0.0 {0.340078080003 0.602044279691 0.586588790603} O5 441 -1 1 {} H 0.0 {0.330417415037 0.602660649827 0.590652244711} H4 442 -1 8 {} O 0.0 {0.355421533852 0.593606412059 0.56218920249} O6 443 -1 1 {} H 0.0 {0.356796193512 0.597452466176 0.552525452905} H5 444 -1 8 {} O 0.0 {0.326764437812 0.585232184242 0.565555060872} O7 445 -1 1 {} H 0.0 {0.331857978922 0.576552927567 0.562565075433} H6 446 -1 1 {} H 0.0 {0.675198588292 0.616608322242 0.390445905239} H1 447 -1 8 {} O 0.0 {0.652730699337 0.627959332091 0.374586337797} O3 448 -1 1 {} H 0.0 {0.65029128072 0.629260350697 0.36445359947} H2 449 -1 14 {} Si 0.0 {0.518657155852 0.643283808378 0.38966295189} Si1 450 -1 8 {} O 0.0 {0.516186036051 0.640558619524 0.40761999807} O1 451 -1 14 {} Si 0.0 {0.532255947336 0.635686952842 0.415000775467} Si2 452 -1 8 {} O 0.0 {0.53581268768 0.646464487878 0.429417649211} O2 453 -1 1 {} H 0.0 {0.538523234062 0.656038619352 0.426064947551} H1 454 -1 8 {} O 0.0 {0.531531511338 0.618064345212 0.420316936062} O3 455 -1 1 {} H 0.0 {0.524812774556 0.612839903932 0.414188611056} H2 456 -1 8 {} O 0.0 {0.545549025688 0.63780973902 0.402409521357} O4 457 -1 1 {} H 0.0 {0.554914889352 0.637169954194 0.407085141151} H3 458 -1 8 {} O 0.0 {0.531657912459 0.656078542565 0.38716090832} O5 459 -1 1 {} H 0.0 {0.540128291558 0.651661721487 0.382844103107} H4 460 -1 8 {} O 0.0 {0.502906018307 0.648917172448 0.382010277412} O6 461 -1 1 {} H 0.0 {0.504751485728 0.652075706367 0.372169780228} H5 462 -1 8 {} O 0.0 {0.523985510388 0.627472724286 0.381977446628} O7 463 -1 1 {} H 0.0 {0.515673936304 0.621172572614 0.380870391363} H6 464 -1 14 {} Si 0.0 {0.408845024698 0.403915990389 0.613151518481} Si1 465 -1 8 {} O 0.0 {0.402803479951 0.390658808822 0.602053546137} O1 466 -1 14 {} Si 0.0 {0.402810866557 0.374811487787 0.611181197471} Si2 467 -1 8 {} O 0.0 {0.416212556191 0.364080300747 0.604636689032} O2 468 -1 1 {} H 0.0 {0.424917351531 0.369823982425 0.603296473638} H1 469 -1 8 {} O 0.0 {0.405718346063 0.378069057468 0.629049210125} O3 470 -1 1 {} H 0.0 {0.396611537578 0.380468923438 0.633684317259} H2 471 -1 8 {} O 0.0 {0.386547947085 0.366509876917 0.609004735956} O4 472 -1 1 {} H 0.0 {0.38806526091 0.356300619798 0.607193653795} H3 473 -1 8 {} O 0.0 {0.402631077933 0.400989094761 0.630217696638} O5 474 -1 1 {} H 0.0 {0.410435279759 0.397303432648 0.636190016517} H4 475 -1 8 {} O 0.0 {0.402626763646 0.419996042359 0.607087320374} O6 476 -1 1 {} H 0.0 {0.399093608704 0.418891226095 0.597265698353} H5 477 -1 8 {} O 0.0 {0.427258683054 0.403997733536 0.613204483095} O7 478 -1 1 {} H 0.0 {0.430719936814 0.404320792582 0.623117369284} H6 479 -1 14 {} Si 0.0 {0.431714029094 0.660259382016 0.632960985147} Si1 480 -1 8 {} O 0.0 {0.417208909243 0.649258736903 0.63575375476} O1 481 -1 14 {} Si 0.0 {0.40495406815 0.651707129674 0.622198988708} Si2 482 -1 8 {} O 0.0 {0.392047798455 0.663673722794 0.627603622641} O2 483 -1 1 {} H 0.0 {0.382579240305 0.659191703919 0.626819293935} H1 484 -1 8 {} O 0.0 {0.413510925961 0.658271064966 0.607322516082} O3 485 -1 1 {} H 0.0 {0.415077083316 0.650473888481 0.600478012536} H2 486 -1 8 {} O 0.0 {0.397050021072 0.63560897962 0.618081936951} O4 487 -1 1 {} H 0.0 {0.390943869051 0.63257638143 0.626059490898} H3 488 -1 8 {} O 0.0 {0.446083540528 0.654278538462 0.64290509248} O5 489 -1 1 {} H 0.0 {0.449450516613 0.645142494023 0.639045086091} H4 490 -1 8 {} O 0.0 {0.427433421885 0.677425255321 0.638033927611} O6 491 -1 1 {} H 0.0 {0.426490321526 0.683449800545 0.629481003586} H5 492 -1 8 {} O 0.0 {0.436155272305 0.660107343776 0.615185290808} O7 493 -1 1 {} H 0.0 {0.428263676221 0.664088822563 0.609604192647} H6 494 -1 14 {} Si 0.0 {0.449896880212 0.442266733637 0.690250608778} Si1 495 -1 8 {} O 0.0 {0.449926765078 0.458943757989 0.682493038022} O1 496 -1 14 {} Si 0.0 {0.436388552148 0.459870944775 0.670041996878} Si2 497 -1 8 {} O 0.0 {0.420847143544 0.453317155626 0.677396530712} O2 498 -1 1 {} H 0.0 {0.418413290555 0.444176647785 0.67284055372} H1 499 -1 8 {} O 0.0 {0.433860779244 0.477371564414 0.664962245898} O3 500 -1 1 {} H 0.0 {0.433303830606 0.477919615567 0.654489203913} H2 501 -1 8 {} O 0.0 {0.440904556167 0.44981400799 0.655309240925} O4 502 -1 1 {} H 0.0 {0.439975571151 0.439618113513 0.657628187372} H3 503 -1 8 {} O 0.0 {0.435209735475 0.440646164992 0.701209541282} O5 504 -1 1 {} H 0.0 {0.428991097797 0.43299992309 0.697600052472} H4 505 -1 8 {} O 0.0 {0.465236082895 0.43999774475 0.700171549316} O6 506 -1 1 {} H 0.0 {0.470848258587 0.44886067236 0.7000068331} H5 507 -1 8 {} O 0.0 {0.449174165156 0.42944183311 0.677099454052} O7 508 -1 1 {} H 0.0 {0.440778928506 0.423366448016 0.67863047738} H6 509 -1 14 {} Si 0.0 {0.414653451538 0.68198611734 0.465335602725} Si1 510 -1 8 {} O 0.0 {0.401006231307 0.671000623191 0.470984529464} O1 511 -1 14 {} Si 0.0 {0.395288154134 0.676353611253 0.487639982554} Si2 512 -1 8 {} O 0.0 {0.406720225906 0.669760775558 0.500465004273} O2 513 -1 1 {} H 0.0 {0.40482000137 0.659533781306 0.501903688531} H1 514 -1 8 {} O 0.0 {0.395097303064 0.694734192378 0.488453370641} O3 515 -1 1 {} H 0.0 {0.386124104576 0.698311094375 0.484336307335} H2 516 -1 8 {} O 0.0 {0.378318052795 0.669912116247 0.49065768107} O4 517 -1 1 {} H 0.0 {0.37841482397 0.663629657002 0.499070315151} H3 518 -1 8 {} O 0.0 {0.43025158412 0.677292953469 0.473887870008} O5 519 -1 1 {} H 0.0 {0.430047783772 0.667039676964 0.476127489822} H4 520 -1 8 {} O 0.0 {0.410512841279 0.699469813786 0.46929944646} O6 521 -1 1 {} H 0.0 {0.41037653541 0.705112433986 0.460444641842} H5 522 -1 8 {} O 0.0 {0.416848485753 0.6801780233 0.447159494986} O7 523 -1 1 {} H 0.0 {0.419998727748 0.689329864068 0.443091879711} H6 524 -1 1 {} H 0.0 {0.310437430515 0.643919235776 0.526633813366} H1 525 -1 8 {} O 0.0 {0.291533160568 0.614511311577 0.537773707808} O7 526 -1 1 {} H 0.0 {0.298301894375 0.613486000819 0.545743039859} H6 527 -1 14 {} Si 0.0 {0.399120200911 0.519055008108 0.325612635719} Si1 528 -1 8 {} O 0.0 {0.391034844333 0.534360358576 0.319411569996} O1 529 -1 14 {} Si 0.0 {0.376540762464 0.538116182526 0.330068284233} Si2 530 -1 8 {} O 0.0 {0.377420848668 0.555581775344 0.335791377644} O2 531 -1 1 {} H 0.0 {0.387186737838 0.557743985632 0.338930249915} H1 532 -1 8 {} O 0.0 {0.360912750185 0.535633958468 0.320530743853} O3 533 -1 1 {} H 0.0 {0.360304015913 0.525662856582 0.317248554183} H2 534 -1 8 {} O 0.0 {0.376711261744 0.526874405887 0.344659251034} O4 535 -1 1 {} H 0.0 {0.381667092566 0.531565547642 0.352617392372} H3 536 -1 8 {} O 0.0 {0.416442982447 0.518239311137 0.319463158573} O5 537 -1 1 {} H 0.0 {0.419924305337 0.52794740032 0.317535118934} H4 538 -1 8 {} O 0.0 {0.389785194014 0.504381553115 0.319626517399} O6 539 -1 1 {} H 0.0 {0.386008470851 0.499061571031 0.327848416431} H5 540 -1 8 {} O 0.0 {0.399139220272 0.519209571699 0.344019746566} O7 541 -1 1 {} H 0.0 {0.395709047454 0.509953882622 0.34759348186} H6 542 -1 8 {} O 0.0 {0.262534175228 0.511828358825 0.521052493512} O1 543 -1 14 {} Si 0.0 {0.256533111028 0.495081838432 0.516678359307} Si2 544 -1 8 {} O 0.0 {0.270299834694 0.485364693379 0.509330992246} O3 545 -1 1 {} H 0.0 {0.273620600181 0.490120074649 0.500572788868} H2 546 -1 8 {} O 0.0 {0.257559279756 0.531844515632 0.499321946104} O5 547 -1 1 {} H 0.0 {0.253272197303 0.527334181072 0.490858502646} H4 548 -1 14 {} Si 0.0 {0.378991404477 0.541951472159 0.44909722329} Si1 549 -1 8 {} O 0.0 {0.376797191 0.524171640596 0.445001027079} O1 550 -1 14 {} Si 0.0 {0.358856452338 0.520173846364 0.445020891521} Si2 551 -1 8 {} O 0.0 {0.349629406613 0.533638490056 0.453508223055} O2 552 -1 1 {} H 0.0 {0.353413933852 0.53486262966 0.463228446023} H1 553 -1 8 {} O 0.0 {0.352888783217 0.518626476825 0.427690675426} O3 554 -1 1 {} H 0.0 {0.360636338336 0.514911290636 0.421656725892} H2 555 -1 8 {} O 0.0 {0.356093966452 0.504316467415 0.453910125851} O4 556 -1 1 {} H 0.0 {0.350816634999 0.506177219412 0.462794905642} H3 557 -1 8 {} O 0.0 {0.370507232889 0.545629942976 0.464971051573} O5 558 -1 1 {} H 0.0 {0.363157857976 0.55295213504 0.463381481155} H4 559 -1 8 {} O 0.0 {0.371685932532 0.552259400238 0.43572914969} O6 560 -1 1 {} H 0.0 {0.379226916161 0.555090519806 0.42900098852} H5 561 -1 8 {} O 0.0 {0.396901019488 0.545766859781 0.450695049499} O7 562 -1 1 {} H 0.0 {0.398292348964 0.556170215481 0.450361819339} H6 563 -1 14 {} Si 0.0 {0.454067209591 0.630896812819 0.610684705097} Si1 564 -1 8 {} O 0.0 {0.443761007105 0.646046784743 0.611186455229} O1 565 -1 14 {} Si 0.0 {0.454735700836 0.660717436018 0.609611227504} Si2 566 -1 8 {} O 0.0 {0.471248027628 0.65530581616 0.603615737569} O2 567 -1 1 {} H 0.0 {0.473590711206 0.645986563768 0.607845201287} H1 568 -1 8 {} O 0.0 {0.447450307519 0.672590381614 0.597640165725} O3 569 -1 1 {} H 0.0 {0.438413059531 0.676298246932 0.601484399932} H2 570 -1 8 {} O 0.0 {0.456538401638 0.668852788507 0.626007025466} O4 571 -1 1 {} H 0.0 {0.4667078887 0.669262081779 0.628592037295} H3 572 -1 8 {} O 0.0 {0.461078986143 0.627762046622 0.627354736885} O5 573 -1 1 {} H 0.0 {0.469850387679 0.622103135869 0.626419296807} H4 574 -1 8 {} O 0.0 {0.467734183582 0.633302834062 0.598619258747} O6 575 -1 1 {} H 0.0 {0.47078942927 0.623998338915 0.594902598912} H5 576 -1 8 {} O 0.0 {0.443784401292 0.61654316975 0.605585564951} O7 577 -1 1 {} H 0.0 {0.449665401187 0.607869279496 0.605569436455} H6 578 -1 8 {} O 0.0 {0.445248194908 0.655073332227 0.668807798082} O5 579 -1 1 {} H 0.0 {0.455697294943 0.654981507048 0.669832568365} H4 580 -1 1 {} H 0.0 {0.416489226799 0.638343087093 0.672323816736} H5 581 -1 8 {} O 0.0 {0.443567042995 0.626975352528 0.679510957917} O7 582 -1 1 {} H 0.0 {0.438586791236 0.622637047872 0.671345718847} H6 583 -1 14 {} Si 0.0 {0.666979737465 0.609985370559 0.578235021366} Si1 584 -1 8 {} O 0.0 {0.673005333561 0.612417574948 0.561010934054} O1 585 -1 14 {} Si 0.0 {0.661714772403 0.603734899738 0.549365867228} Si2 586 -1 8 {} O 0.0 {0.669590153636 0.588105987225 0.543710292882} O2 587 -1 1 {} H 0.0 {0.674833203339 0.589872588649 0.534788161903} H1 588 -1 8 {} O 0.0 {0.645906562487 0.599883128247 0.557943246063} O3 589 -1 1 {} H 0.0 {0.643279144703 0.607916355776 0.564174916048} H2 590 -1 8 {} O 0.0 {0.658326240822 0.614511395008 0.534830302998} O4 591 -1 1 {} H 0.0 {0.665613173644 0.622043603779 0.53428968484} H3 592 -1 8 {} O 0.0 {0.680471510729 0.602898682654 0.588553396344} O5 593 -1 1 {} H 0.0 {0.687863658725 0.598820709027 0.582318174639} H4 594 -1 8 {} O 0.0 {0.652649162912 0.598443353687 0.578124381881} O6 595 -1 1 {} H 0.0 {0.645954039344 0.601121011849 0.585753842704} H5 596 -1 8 {} O 0.0 {0.661760302159 0.626169868215 0.585246179638} O7 597 -1 1 {} H 0.0 {0.652706556393 0.62912322838 0.580831202445} H6 598 -1 14 {} Si 0.0 {0.622371964675 0.374151726077 0.592631856057} Si1 599 -1 8 {} O 0.0 {0.604643138459 0.373147673941 0.597574902721} O1 600 -1 14 {} Si 0.0 {0.603354712357 0.368208751699 0.615275803321} Si2 601 -1 8 {} O 0.0 {0.600463645529 0.383141624254 0.625628924436} O2 602 -1 1 {} H 0.0 {0.606478958169 0.39101061927 0.622163787797} H1 603 -1 8 {} O 0.0 {0.589293417256 0.356536065083 0.617354304049} O3 604 -1 1 {} H 0.0 {0.592778196341 0.346690027914 0.616408280393} H2 605 -1 8 {} O 0.0 {0.618953919035 0.360002135038 0.620547533969} O4 606 -1 1 {} H 0.0 {0.626053532466 0.367305886923 0.623078165065} H3 607 -1 8 {} O 0.0 {0.629931913376 0.389255712607 0.599918613058} O5 608 -1 1 {} H 0.0 {0.627721492089 0.389656502924 0.610172231796} H4 609 -1 8 {} O 0.0 {0.623545050812 0.374967269312 0.574276276216} O6 610 -1 1 {} H 0.0 {0.631983302495 0.369604383385 0.571069496788} H5 611 -1 8 {} O 0.0 {0.631361021573 0.359275241505 0.598688269833} O7 612 -1 1 {} H 0.0 {0.640913381525 0.358950070199 0.594322818336} H6 613 -1 14 {} Si 0.0 {0.52956422737 0.483669774916 0.504343349021} Si1 614 -1 8 {} O 0.0 {0.517544327552 0.473320441314 0.513671222996} O1 615 -1 14 {} Si 0.0 {0.500500979669 0.479846852899 0.51098057291} Si2 616 -1 8 {} O 0.0 {0.492070167455 0.469738319148 0.498167887738} O2 617 -1 1 {} H 0.0 {0.499170603064 0.466177952651 0.491308425094} H1 618 -1 8 {} O 0.0 {0.491001643303 0.478971406918 0.52658551306} O3 619 -1 1 {} H 0.0 {0.492180837447 0.487931490179 0.531827184134} H2 620 -1 8 {} O 0.0 {0.501290467325 0.49742178849 0.505542234228} O4 621 -1 1 {} H 0.0 {0.493148091049 0.502667637274 0.5095501253} H3 622 -1 8 {} O 0.0 {0.529727879078 0.500660483676 0.511492941246} O5 623 -1 1 {} H 0.0 {0.530482984169 0.500028060011 0.521953023193} H4 624 -1 8 {} O 0.0 {0.52458130012 0.48439193586 0.486613426489} O6 625 -1 1 {} H 0.0 {0.516992579392 0.477351734043 0.484828791622} H5 626 -1 8 {} O 0.0 {0.54636011428 0.47637053088 0.505588597732} O7 627 -1 1 {} H 0.0 {0.548163063369 0.470341865757 0.497170869018} H6 628 -1 14 {} Si 0.0 {0.652203596925 0.425107511448 0.609282722933} Si1 629 -1 8 {} O 0.0 {0.657179376338 0.412585226731 0.596666512408} O1 630 -1 14 {} Si 0.0 {0.645066347347 0.412444784802 0.582755104714} Si2 631 -1 8 {} O 0.0 {0.65173913322 0.42226356414 0.568704772636} O2 632 -1 1 {} H 0.0 {0.662207117298 0.42259574844 0.569330362927} H1 633 -1 8 {} O 0.0 {0.642222141886 0.39511507796 0.577290648295} O3 634 -1 1 {} H 0.0 {0.644983838852 0.388536891976 0.584989863388} H2 635 -1 8 {} O 0.0 {0.629149002271 0.419811778692 0.588336505205} O4 636 -1 1 {} H 0.0 {0.62850103531 0.429722150956 0.58490912671} H3 637 -1 8 {} O 0.0 {0.636134485361 0.420259867612 0.616790710783} O5 638 -1 1 {} H 0.0 {0.637290340659 0.411181559743 0.621914160604} H4 639 -1 8 {} O 0.0 {0.650464687773 0.441627588873 0.601276172959} O6 640 -1 1 {} H 0.0 {0.641257248049 0.445895047529 0.604015186508} H5 641 -1 8 {} O 0.0 {0.665074356429 0.425950577651 0.622379791293} O7 642 -1 1 {} H 0.0 {0.663531048607 0.434494337878 0.628206560111} H6 643 -1 14 {} Si 0.0 {0.602705989367 0.591737157322 0.292693058956} Si1 644 -1 1 {} H 0.0 {0.594042473221 0.572796957633 0.280736436714} H4 645 -1 8 {} O 0.0 {0.590932869272 0.588808736371 0.306521997999} O7 646 -1 1 {} H 0.0 {0.58935634105 0.597787323753 0.311723451081} H6 647 -1 14 {} Si 0.0 {0.510807624404 0.501738196147 0.564609498853} Si1 648 -1 8 {} O 0.0 {0.501616984748 0.510942199321 0.551689600515} O1 649 -1 14 {} Si 0.0 {0.509108612989 0.527571300184 0.549823144203} Si2 650 -1 8 {} O 0.0 {0.521817490355 0.527071623969 0.536550324544} O2 651 -1 1 {} H 0.0 {0.523399178143 0.517115205812 0.533594213724} H1 652 -1 8 {} O 0.0 {0.496042340798 0.539656301238 0.54547537063} O3 653 -1 1 {} H 0.0 {0.487403670352 0.537592084823 0.551061817356} H2 654 -1 8 {} O 0.0 {0.516935416943 0.532477911218 0.565711675486} O4 655 -1 1 {} H 0.0 {0.515709443888 0.52477496338 0.572733016147} H3 656 -1 8 {} O 0.0 {0.503059624559 0.504805712967 0.580972163165} O5 657 -1 1 {} H 0.0 {0.496938494834 0.496678993555 0.583464727096} H4 658 -1 8 {} O 0.0 {0.528295896756 0.507448249677 0.564924139959} O6 659 -1 1 {} H 0.0 {0.531146420052 0.510477528269 0.555278100225} H5 660 -1 8 {} O 0.0 {0.510277932844 0.48378280411 0.560838842771} O7 661 -1 1 {} H 0.0 {0.510188156227 0.482448147839 0.550440353332} H6 662 -1 14 {} Si 0.0 {0.431124450432 0.589900643942 0.347563014198} Si1 663 -1 8 {} O 0.0 {0.438152933204 0.572886100318 0.346665843269} O1 664 -1 14 {} Si 0.0 {0.436528521405 0.566154235061 0.329572019433} Si2 665 -1 8 {} O 0.0 {0.419028683931 0.561437531691 0.326406052075} O2 666 -1 1 {} H 0.0 {0.417659740948 0.551299224333 0.328801210509} H1 667 -1 8 {} O 0.0 {0.441810531416 0.578813206094 0.317322318431} O3 668 -1 1 {} H 0.0 {0.445972346611 0.574025151008 0.308933961481} H2 669 -1 8 {} O 0.0 {0.447218979876 0.551295833392 0.327956533074} O4 670 -1 1 {} H 0.0 {0.450718808136 0.548508618219 0.337452848923} H3 671 -1 8 {} O 0.0 {0.4182145781 0.592019541656 0.33462176197} O5 672 -1 1 {} H 0.0 {0.410707686501 0.584807948949 0.335960718827} H4 673 -1 8 {} O 0.0 {0.444528919096 0.60223043531 0.344968691056} O6 674 -1 1 {} H 0.0 {0.446340444402 0.607357245731 0.353959227098} H5 675 -1 8 {} O 0.0 {0.4236543556 0.592482779262 0.364176023524} O7 676 -1 1 {} H 0.0 {0.431016062467 0.591139562572 0.371547841474} H6 677 -1 8 {} O 0.0 {0.548704452604 0.612477624588 0.701720779786} O6 678 -1 1 {} H 0.0 {0.548374870571 0.602898533635 0.706039977484} H5 679 -1 14 {} Si 0.0 {0.500695062824 0.444255332278 0.624009993592} Si1 680 -1 8 {} O 0.0 {0.512054865946 0.449551534403 0.610579211564} O1 681 -1 14 {} Si 0.0 {0.527849576465 0.455827788111 0.617792023544} Si2 682 -1 8 {} O 0.0 {0.525492183708 0.473068926803 0.623758681422} O2 683 -1 1 {} H 0.0 {0.534302239857 0.478545624608 0.622164732762} H1 684 -1 8 {} O 0.0 {0.532942766325 0.445126138962 0.631873749035} O3 685 -1 1 {} H 0.0 {0.525628081543 0.437790361887 0.63351942548} H2 686 -1 8 {} O 0.0 {0.540968453913 0.455594241003 0.604879677766} O4 687 -1 1 {} H 0.0 {0.547178948655 0.463978402661 0.606062482608} H3 688 -1 8 {} O 0.0 {0.496277211012 0.426536974049 0.621676471038} O5 689 -1 1 {} H 0.0 {0.504759597834 0.420575507843 0.623325456836} H4 690 -1 8 {} O 0.0 {0.485416671712 0.454488936688 0.623443022302} O6 691 -1 1 {} H 0.0 {0.483929476201 0.459051191578 0.632771044466} H5 692 -1 8 {} O 0.0 {0.508975698736 0.446444827661 0.64027511679} O7 693 -1 1 {} H 0.0 {0.517981661748 0.451660640269 0.638919496423} H6 694 -1 14 {} Si 0.0 {0.344787293423 0.659376848981 0.554274300911} Si1 695 -1 8 {} O 0.0 {0.323832257901 0.659639937124 0.521199896936} O2 696 -1 8 {} O 0.0 {0.321616344023 0.63928923955 0.543196921014} O3 697 -1 1 {} H 0.0 {0.319261233382 0.637839269177 0.553317100583} H2 698 -1 8 {} O 0.0 {0.352498807289 0.651981642926 0.539207510419} O5 699 -1 1 {} H 0.0 {0.351870513368 0.658783168601 0.531221670007} H4 700 -1 8 {} O 0.0 {0.341562637623 0.646140566884 0.566608547672} O6 701 -1 1 {} H 0.0 {0.350391373058 0.644116111527 0.571925198989} H5 702 -1 8 {} O 0.0 {0.356224700725 0.671778718671 0.561512294111} O7 703 -1 1 {} H 0.0 {0.352107003898 0.675542465248 0.570366129941} H6 704 -1 8 {} O 0.0 {0.372357615606 0.325229204788 0.369722589095} O2 705 -1 1 {} H 0.0 {0.380461191292 0.318886704588 0.371754449002} H1 706 -1 8 {} O 0.0 {0.446522139448 0.499883283322 0.725635707039} O3 707 -1 1 {} H 0.0 {0.453353460802 0.493340914621 0.730174110506} H2 708 -1 14 {} Si 0.0 {0.491985914174 0.258802994439 0.458847972829} Si1 709 -1 8 {} O 0.0 {0.497133378283 0.275150449861 0.451752755379} O1 710 -1 14 {} Si 0.0 {0.515228937184 0.274655096875 0.447726267179} Si2 711 -1 8 {} O 0.0 {0.517770015125 0.266008962008 0.431590134179} O2 712 -1 1 {} H 0.0 {0.512145724193 0.257115814871 0.431435335011} H1 713 -1 8 {} O 0.0 {0.521947851893 0.291724741675 0.446665571102} O3 714 -1 1 {} H 0.0 {0.521119599997 0.296368812798 0.456017195669} H2 715 -1 8 {} O 0.0 {0.52399038615 0.26542821811 0.461013375657} O4 716 -1 1 {} H 0.0 {0.522708632323 0.255056680282 0.459598711216} H3 717 -1 8 {} O 0.0 {0.506019380125 0.251798330131 0.468514098861} O5 718 -1 1 {} H 0.0 {0.504635553286 0.253905902479 0.478705407541} H4 719 -1 8 {} O 0.0 {0.487524430516 0.24726976988 0.445196280835} O6 720 -1 1 {} H 0.0 {0.477617023005 0.249060824957 0.44219875958} H5 721 -1 8 {} O 0.0 {0.477387647375 0.261006921593 0.470031711698} O7 722 -1 1 {} H 0.0 {0.469776269839 0.26607568456 0.464947475566} H6 723 -1 14 {} Si 0.0 {0.410390244804 0.505659137688 0.599667854675} Si1 724 -1 8 {} O 0.0 {0.408187875936 0.523887503497 0.598975443018} O1 725 -1 14 {} Si 0.0 {0.398757703502 0.528324506606 0.583791139609} Si2 726 -1 8 {} O 0.0 {0.399522350839 0.546549200746 0.581163737234} O2 727 -1 1 {} H 0.0 {0.392402737313 0.55126539163 0.587271510969} H1 728 -1 8 {} O 0.0 {0.406131736372 0.519739695256 0.569293820178} O3 729 -1 1 {} H 0.0 {0.414406489033 0.514086980117 0.572427819771} H2 730 -1 8 {} O 0.0 {0.381237981369 0.523143757826 0.585755978617} O4 731 -1 1 {} H 0.0 {0.375711376675 0.526365430669 0.577447914986} H3 732 -1 8 {} O 0.0 {0.423436540194 0.501505569194 0.611961424136} O5 733 -1 1 {} H 0.0 {0.421147380215 0.506039679356 0.621148111174} H4 734 -1 8 {} O 0.0 {0.415391110677 0.499464809437 0.583087916139} O6 735 -1 1 {} H 0.0 {0.408675072689 0.492025695642 0.579971905724} H5 736 -1 8 {} O 0.0 {0.394531080495 0.497788515496 0.604649122502} O7 737 -1 1 {} H 0.0 {0.391858386348 0.490542434812 0.597544848468} H6 738 -1 14 {} Si 0.0 {0.451500006969 0.49692943876 0.557448725608} Si1 739 -1 8 {} O 0.0 {0.458751835148 0.492444618004 0.573783354104} O1 740 -1 14 {} Si 0.0 {0.445547393956 0.486149934254 0.584993239775} Si2 741 -1 8 {} O 0.0 {0.445151966113 0.496338396873 0.600314267401} O2 742 -1 1 {} H 0.0 {0.452134490305 0.492566611249 0.607193789225} H1 743 -1 8 {} O 0.0 {0.429229706756 0.487166595341 0.576546424075} O3 744 -1 1 {} H 0.0 {0.430554122074 0.485869674606 0.566222396882} H2 745 -1 8 {} O 0.0 {0.449094421637 0.468637391434 0.589396730606} O4 746 -1 1 {} H 0.0 {0.454581467087 0.468334243134 0.598349101949} H3 747 -1 8 {} O 0.0 {0.438842659985 0.510080339543 0.559734185252} O5 748 -1 1 {} H 0.0 {0.44218743269 0.516918113331 0.566959553195} H4 749 -1 8 {} O 0.0 {0.44362714401 0.482096959815 0.549902161748} O6 750 -1 1 {} H 0.0 {0.450387509826 0.474069668686 0.550100827921} H5 751 -1 8 {} O 0.0 {0.464822979724 0.503149425356 0.546358282179} O7 752 -1 1 {} H 0.0 {0.467962690398 0.49543362283 0.539985910227} H6 753 -1 14 {} Si 0.0 {0.493776257456 0.544753392272 0.459173627779} Si1 754 -1 8 {} O 0.0 {0.508709605075 0.555606982557 0.458989908286} O1 755 -1 14 {} Si 0.0 {0.506620326645 0.5692023808 0.446690059423} Si2 756 -1 8 {} O 0.0 {0.492220970405 0.579622998167 0.451369646188} O2 757 -1 1 {} H 0.0 {0.487842994679 0.583624259076 0.442700100658} H1 758 -1 8 {} O 0.0 {0.521839930829 0.579552705026 0.446432786878} O3 759 -1 1 {} H 0.0 {0.526788025592 0.57870999565 0.455662232576} H2 760 -1 8 {} O 0.0 {0.503807060838 0.562104190649 0.429964163833} O4 761 -1 1 {} H 0.0 {0.494312116579 0.564985839183 0.426513243861} H3 762 -1 8 {} O 0.0 {0.478564541635 0.555086088012 0.458580400953} O5 763 -1 1 {} H 0.0 {0.470728671103 0.549509785716 0.454344493514} H4 764 -1 8 {} O 0.0 {0.493736548288 0.534697148089 0.474597362475} O6 765 -1 1 {} H 0.0 {0.494040190892 0.524493696374 0.472116950967} H5 766 -1 8 {} O 0.0 {0.494134321397 0.533519726363 0.444609910203} O7 767 -1 1 {} H 0.0 {0.500823730403 0.52564413583 0.446453590165} H6 768 -1 14 {} Si 0.0 {0.436492454701 0.446712624799 0.3070780933} Si1 769 -1 8 {} O 0.0 {0.422809188556 0.452156425502 0.296127072558} O1 770 -1 14 {} Si 0.0 {0.410052537106 0.438952297604 0.295659937773} Si2 771 -1 8 {} O 0.0 {0.401132919116 0.439537238597 0.279586213272} O2 772 -1 1 {} H 0.0 {0.396027915366 0.448665337816 0.278763723324} H1 773 -1 8 {} O 0.0 {0.418206618968 0.422560640336 0.297551724804} O3 774 -1 1 {} H 0.0 {0.415299421958 0.41824754324 0.306667625792} H2 775 -1 8 {} O 0.0 {0.398132128472 0.441504315292 0.30943757975} O4 776 -1 1 {} H 0.0 {0.389975930199 0.435017975116 0.308239659168} H3 777 -1 8 {} O 0.0 {0.446610022139 0.434102089488 0.298319634698} O5 778 -1 1 {} H 0.0 {0.44189654151 0.431524388785 0.289288608831} H4 779 -1 8 {} O 0.0 {0.429426489169 0.439363347045 0.322394285027} O6 780 -1 1 {} H 0.0 {0.43721582734 0.436431842985 0.32877383475} H5 781 -1 8 {} O 0.0 {0.44703738716 0.461127186257 0.311471434396} O7 782 -1 1 {} H 0.0 {0.448437678916 0.46137446077 0.321878127238} H6 783 -1 8 {} O 0.0 {0.714061744003 0.536829003408 0.412439620747} O3 784 -1 1 {} H 0.0 {0.707563850108 0.541158766404 0.419454856836} H2 785 -1 8 {} O 0.0 {0.723295700001 0.501677301523 0.410543227387} O5 786 -1 1 {} H 0.0 {0.722245026892 0.500220900242 0.400222936892} H4 787 -1 14 {} Si 0.0 {0.460010105353 0.441342351192 0.266129018087} Si1 788 -1 8 {} O 0.0 {0.458863078895 0.423821698314 0.260819138586} O1 789 -1 8 {} O 0.0 {0.471885072847 0.450075452762 0.255226256725} O5 790 -1 1 {} H 0.0 {0.477999200633 0.443049689186 0.250384621244} H4 791 -1 8 {} O 0.0 {0.465848199574 0.442187911811 0.2835657553} O6 792 -1 1 {} H 0.0 {0.458494508135 0.446796846839 0.28948781824} H5 793 -1 8 {} O 0.0 {0.44347703081 0.449285692446 0.264784580655} O7 794 -1 1 {} H 0.0 {0.44014432721 0.452033090578 0.274350315104} H6 795 -1 14 {} Si 0.0 {0.584574613864 0.493322138744 0.425436038276} Si1 796 -1 8 {} O 0.0 {0.580944607348 0.501485067989 0.441551358152} O1 797 -1 14 {} Si 0.0 {0.593842269762 0.497061441841 0.453946630435} Si2 798 -1 8 {} O 0.0 {0.586036544972 0.495549690501 0.470538576548} O2 799 -1 1 {} H 0.0 {0.576297846605 0.499479460757 0.470178707622} H1 800 -1 8 {} O 0.0 {0.60167409416 0.481044482357 0.449358299791} O3 801 -1 1 {} H 0.0 {0.594414148797 0.474632748843 0.445332006663} H2 802 -1 8 {} O 0.0 {0.606680727505 0.510235223814 0.45442324504} O4 803 -1 1 {} H 0.0 {0.6025019704 0.519033830987 0.458342434704} H3 804 -1 8 {} O 0.0 {0.600736326769 0.484584984401 0.426376749204} O5 805 -1 1 {} H 0.0 {0.600384778549 0.475959549795 0.420378631817} H4 806 -1 8 {} O 0.0 {0.58523907022 0.506053773033 0.412169293916} O6 807 -1 1 {} H 0.0 {0.575766979297 0.510472701294 0.411103527488} H5 808 -1 8 {} O 0.0 {0.571283560834 0.481197138291 0.421584257155} O7 809 -1 1 {} H 0.0 {0.569139948261 0.481520401026 0.411307078478} H6 810 -1 8 {} O 0.0 {0.425756454931 0.620597552543 0.691771800303} O7 811 -1 1 {} H 0.0 {0.433916582789 0.61634430645 0.696848441859} H6 812 -1 14 {} Si 0.0 {0.591811567513 0.261486234318 0.508733941247} Si1 813 -1 8 {} O 0.0 {0.58192860576 0.262518979918 0.524204944601} O1 814 -1 14 {} Si 0.0 {0.564721428348 0.267544270085 0.520056847419} Si2 815 -1 8 {} O 0.0 {0.552828952365 0.256296236759 0.52846338908} O2 816 -1 1 {} H 0.0 {0.551161542478 0.247862962534 0.522435897287} H1 817 -1 8 {} O 0.0 {0.561862017119 0.284812198557 0.525709387584} O3 818 -1 1 {} H 0.0 {0.555597623321 0.28971920071 0.518862110619} H2 819 -1 8 {} O 0.0 {0.562268044508 0.26655925278 0.501853340486} O4 820 -1 1 {} H 0.0 {0.557994107623 0.257285797836 0.499402991401} H3 821 -1 8 {} O 0.0 {0.606892153199 0.271887198098 0.510370137947} O6 822 -1 1 {} H 0.0 {0.605657918729 0.280705895583 0.504795619345} H5 823 -1 8 {} O 0.0 {0.581686124266 0.267552316276 0.494606262333} O7 824 -1 1 {} H 0.0 {0.583912254295 0.277643346849 0.492791900634} H6 825 -1 14 {} Si 0.0 {0.320334067589 0.364115942286 0.532521756318} Si1 826 -1 8 {} O 0.0 {0.336963712103 0.357546929845 0.527264198367} O1 827 -1 14 {} Si 0.0 {0.335668876305 0.340075913581 0.520830901504} Si2 828 -1 8 {} O 0.0 {0.332859885745 0.328381213581 0.534762939399} O2 829 -1 1 {} H 0.0 {0.340836405889 0.321575071372 0.535271337399} H1 830 -1 8 {} O 0.0 {0.321791525101 0.338805316851 0.508934857759} O3 831 -1 1 {} H 0.0 {0.324265083386 0.331827224379 0.501471656995} H2 832 -1 8 {} O 0.0 {0.351341298792 0.335512263614 0.512281302596} O4 833 -1 1 {} H 0.0 {0.357430941022 0.330039989928 0.518849257846} H3 834 -1 8 {} O 0.0 {0.314239807055 0.376356463385 0.520177754115} O5 835 -1 1 {} H 0.0 {0.309876000543 0.3845094876 0.525207189228} H4 836 -1 8 {} O 0.0 {0.32191954479 0.372508564356 0.548837905787} O6 837 -1 1 {} H 0.0 {0.31298451528 0.371365383487 0.554222743875} H5 838 -1 8 {} O 0.0 {0.308229299735 0.350317137939 0.533938429035} O7 839 -1 1 {} H 0.0 {0.311366533509 0.343669373748 0.541391113218} H6 840 -1 14 {} Si 0.0 {0.416918595504 0.544731500434 0.450011483806} Si1 841 -1 8 {} O 0.0 {0.409172418672 0.548807504037 0.433829986665} O1 842 -1 14 {} Si 0.0 {0.412410636018 0.535210084537 0.421905850663} Si2 843 -1 8 {} O 0.0 {0.426838247281 0.539594428242 0.411375767909} O2 844 -1 1 {} H 0.0 {0.423433197718 0.542952329897 0.402028117173} H1 845 -1 8 {} O 0.0 {0.416015697812 0.519719051479 0.431124664759} O3 846 -1 1 {} H 0.0 {0.410306618297 0.519498748054 0.439932573509} H2 847 -1 8 {} O 0.0 {0.397613989606 0.532723421385 0.411286059777} O4 848 -1 1 {} H 0.0 {0.400060963985 0.534982465767 0.401333394583} H3 849 -1 8 {} O 0.0 {0.416801510162 0.559644589888 0.460699994459} O5 850 -1 1 {} H 0.0 {0.412681952679 0.567653797648 0.455366095824} H4 851 -1 8 {} O 0.0 {0.434265843122 0.539240861345 0.447328355235} O6 852 -1 1 {} H 0.0 {0.434786161504 0.528793178321 0.448192961244} H5 853 -1 8 {} O 0.0 {0.407400333012 0.53127285704 0.458177727076} O7 854 -1 1 {} H 0.0 {0.412671129564 0.527898119609 0.466606007849} H6 855 -1 14 {} Si 0.0 {0.489931130671 0.471402688961 0.311684431456} Si1 856 -1 8 {} O 0.0 {0.501432670623 0.463049919527 0.323410418849} O1 857 -1 14 {} Si 0.0 {0.518707107726 0.464443369993 0.317129072253} Si2 858 -1 8 {} O 0.0 {0.526689401942 0.479532597335 0.324117043855} O2 859 -1 1 {} H 0.0 {0.519308135995 0.486541577816 0.326713788961} H1 860 -1 8 {} O 0.0 {0.528299581409 0.449556171482 0.322187871513} O3 861 -1 1 {} H 0.0 {0.522515174622 0.443746783232 0.328747296184} H2 862 -1 8 {} O 0.0 {0.518447134653 0.465601314311 0.298779129014} O4 863 -1 1 {} H 0.0 {0.51436965363 0.474840427652 0.295931188257} H3 864 -1 8 {} O 0.0 {0.472540684411 0.468675580925 0.317096564588} O5 865 -1 1 {} H 0.0 {0.468256186191 0.477859457263 0.319856193004} H4 866 -1 8 {} O 0.0 {0.492261776628 0.464401126645 0.294836582768} O6 867 -1 1 {} H 0.0 {0.494249581798 0.472177393594 0.288078238041} H5 868 -1 8 {} O 0.0 {0.493475270305 0.489466230211 0.311387350524} O7 869 -1 1 {} H 0.0 {0.50339440444 0.491037830749 0.308330488967} H6 870 -1 8 {} O 0.0 {0.537447621938 0.448197504821 0.255587722688} O7 871 -1 1 {} H 0.0 {0.544699097454 0.447455218099 0.263135588853} H6 872 -1 14 {} Si 0.0 {0.54011260277 0.658714627542 0.541933869901} Si1 873 -1 8 {} O 0.0 {0.544834803926 0.643168805429 0.551361168427} O1 874 -1 14 {} Si 0.0 {0.5295185332 0.633569308117 0.55613922291} Si2 875 -1 8 {} O 0.0 {0.527235812093 0.634450748609 0.574357756205} O2 876 -1 1 {} H 0.0 {0.536554588674 0.633362567686 0.579080404025} H1 877 -1 8 {} O 0.0 {0.51480815744 0.640980731219 0.54769435834} O3 878 -1 1 {} H 0.0 {0.509909347504 0.633645496738 0.54200033987} H2 879 -1 8 {} O 0.0 {0.531243003717 0.615943121208 0.551078757071} O4 880 -1 1 {} H 0.0 {0.538117990449 0.611150825241 0.55735290061} H3 881 -1 8 {} O 0.0 {0.52538228481 0.666432220021 0.549774478776} O5 882 -1 1 {} H 0.0 {0.523444981954 0.661785728968 0.55893855544} H4 883 -1 8 {} O 0.0 {0.536041550264 0.654311978831 0.524503954832} O6 884 -1 1 {} H 0.0 {0.533321270922 0.663016183463 0.519250324414} H5 885 -1 8 {} O 0.0 {0.554079585639 0.670658629411 0.541947573409} O7 886 -1 1 {} H 0.0 {0.561085589559 0.667837240497 0.534672068018} H6 887 -1 8 {} O 0.0 {0.476441439181 0.641664887674 0.310740700392} O1 888 -1 14 {} Si 0.0 {0.476890900016 0.655685436495 0.322672351832} Si2 889 -1 8 {} O 0.0 {0.459894635207 0.65906297061 0.328831214047} O3 890 -1 1 {} H 0.0 {0.454797766898 0.649984365921 0.330162299985} H2 891 -1 8 {} O 0.0 {0.487741973101 0.651322314854 0.336874225387} O4 892 -1 1 {} H 0.0 {0.49772165984 0.650970456176 0.333660456049} H3 893 -1 1 {} H 0.0 {0.301014779073 0.343173393512 0.447486953383} H1 894 -1 8 {} O 0.0 {0.322081721504 0.31779069657 0.44938699969} O7 895 -1 14 {} Si 0.0 {0.480193659776 0.460959587357 0.334527254039} Si1 896 -1 8 {} O 0.0 {0.496111720936 0.455891645408 0.342187379719} O1 897 -1 14 {} Si 0.0 {0.508617837798 0.469080706743 0.339338110418} Si2 898 -1 8 {} O 0.0 {0.502915394065 0.480085228512 0.325687350385} O2 899 -1 1 {} H 0.0 {0.509470648361 0.479270713149 0.317530377991} H1 900 -1 8 {} O 0.0 {0.51071400564 0.478975934074 0.354661300969} O3 901 -1 1 {} H 0.0 {0.520682599486 0.482171449134 0.355396437383} H2 902 -1 8 {} O 0.0 {0.524711185974 0.461398939567 0.334799788763} O4 903 -1 1 {} H 0.0 {0.527737520388 0.454868995885 0.342449415289} H3 904 -1 8 {} O 0.0 {0.466321665672 0.45699604442 0.345937866185} O5 905 -1 1 {} H 0.0 {0.460281576252 0.465501224098 0.347160552865} H4 906 -1 8 {} O 0.0 {0.47786001474 0.451924813906 0.318651520278} O6 907 -1 1 {} H 0.0 {0.487194297642 0.448780848294 0.315019064764} H5 908 -1 8 {} O 0.0 {0.480505322989 0.479076527523 0.33133323976} O7 909 -1 1 {} H 0.0 {0.477079472882 0.484177802431 0.339847327402} H6 910 -1 14 {} Si 0.0 {0.510698791392 0.272728005399 0.395540546743} Si1 911 -1 8 {} O 0.0 {0.500007555402 0.283975537305 0.405405352281} O1 912 -1 14 {} Si 0.0 {0.510601531843 0.295776083314 0.414716887186} Si2 913 -1 8 {} O 0.0 {0.512090350005 0.290216803204 0.432171624707} O2 914 -1 1 {} H 0.0 {0.503692815528 0.293430451959 0.437587863752} H1 915 -1 8 {} O 0.0 {0.527303649661 0.296380924103 0.407036889631} O3 916 -1 1 {} H 0.0 {0.52778944765 0.304480413318 0.400380440509} H2 917 -1 8 {} O 0.0 {0.503014736508 0.312525807936 0.414248976807} O4 918 -1 1 {} H 0.0 {0.496918041435 0.313826312235 0.422697409982} H3 919 -1 8 {} O 0.0 {0.526699157409 0.28107425804 0.391965864511} O5 920 -1 1 {} H 0.0 {0.533843747428 0.27809620199 0.39906090871} H4 921 -1 8 {} O 0.0 {0.502283989481 0.268568384807 0.379710496343} O6 922 -1 8 {} O 0.0 {0.513824928231 0.257314804703 0.405085512724} O7 923 -1 14 {} Si 0.0 {0.603190204621 0.289776103729 0.540106444054} Si1 924 -1 8 {} O 0.0 {0.604147821739 0.308150123402 0.541295672316} O1 925 -1 14 {} Si 0.0 {0.620344704402 0.314190941215 0.534795111883} Si2 926 -1 8 {} O 0.0 {0.63151210613 0.318059773821 0.548973752209} O2 927 -1 1 {} H 0.0 {0.625772366429 0.319809890513 0.557573250333} H1 928 -1 8 {} O 0.0 {0.628113171734 0.301293646795 0.524124738469} O3 929 -1 1 {} H 0.0 {0.622479373743 0.300181742871 0.51533118191} H2 930 -1 8 {} O 0.0 {0.617716436323 0.329409517376 0.524799952368} O4 931 -1 1 {} H 0.0 {0.625705085481 0.336040932136 0.52638855444} H3 932 -1 8 {} O 0.0 {0.587839587235 0.283876965494 0.548291106551} O5 933 -1 1 {} H 0.0 {0.579502438341 0.287842967474 0.543307949215} H4 934 -1 8 {} O 0.0 {0.617851675271 0.282273937114 0.548359606908} O6 935 -1 8 {} O 0.0 {0.602947058488 0.284879155698 0.522385667096} O7 936 -1 1 {} H 0.0 {0.602219206724 0.293484179536 0.516403275759} H6 937 -1 8 {} O 0.0 {0.273048375743 0.402245656978 0.552939424628} O2 938 -1 1 {} H 0.0 {0.28858410362 0.375514623556 0.549268260466} H3 939 -1 14 {} Si 0.0 {0.543144742666 0.573188394033 0.645481306626} Si1 940 -1 8 {} O 0.0 {0.531319862692 0.584174118666 0.654341908235} O1 941 -1 14 {} Si 0.0 {0.52721510668 0.598647189869 0.643728860311} Si2 942 -1 8 {} O 0.0 {0.528155118179 0.59373593089 0.626013716781} O2 943 -1 1 {} H 0.0 {0.519463155598 0.588454262889 0.623389146537} H1 944 -1 8 {} O 0.0 {0.510204247778 0.604444782169 0.647597863829} O3 945 -1 1 {} H 0.0 {0.509481905676 0.606507654067 0.657865748554} H2 946 -1 8 {} O 0.0 {0.539173301678 0.61225206627 0.646998971589} O4 947 -1 1 {} H 0.0 {0.539682709185 0.614046782515 0.657321129851} H3 948 -1 8 {} O 0.0 {0.558023763432 0.570483314386 0.65596110464} O5 949 -1 1 {} H 0.0 {0.560390133195 0.560255222976 0.656085813864} H4 950 -1 8 {} O 0.0 {0.548163229875 0.581049606909 0.629630054172} O6 951 -1 1 {} H 0.0 {0.546229532136 0.574449629776 0.621695198758} H5 952 -1 8 {} O 0.0 {0.535078505609 0.557022292112 0.642006616302} O7 953 -1 1 {} H 0.0 {0.541863252707 0.550739530699 0.637030516796} H6 954 -1 14 {} Si 0.0 {0.416329331079 0.451521699599 0.423753331418} Si1 955 -1 8 {} O 0.0 {0.40498637777 0.460322931724 0.41172937638} O1 956 -1 14 {} Si 0.0 {0.387176960183 0.455087421309 0.414061884666} Si2 957 -1 8 {} O 0.0 {0.37841353227 0.467020100412 0.425127052158} O2 958 -1 1 {} H 0.0 {0.375204569081 0.462072772099 0.433781419977} H1 959 -1 8 {} O 0.0 {0.3786789721 0.454936385277 0.397705213798} O3 960 -1 1 {} H 0.0 {0.376598255521 0.445058011429 0.394944323471} H2 961 -1 8 {} O 0.0 {0.386495431361 0.438348291816 0.421545847562} O4 962 -1 1 {} H 0.0 {0.378865126171 0.438097416662 0.428763172977} H3 963 -1 8 {} O 0.0 {0.432038755768 0.461112220145 0.425442512874} O5 964 -1 1 {} H 0.0 {0.431374277977 0.470025260745 0.419875549186} H4 965 -1 8 {} O 0.0 {0.420200290037 0.434560902766 0.417625037015} O6 966 -1 1 {} H 0.0 {0.423349922227 0.428583373914 0.425674338105} H5 967 -1 8 {} O 0.0 {0.408217819709 0.450247222803 0.440190986343} O7 968 -1 1 {} H 0.0 {0.409072781378 0.44038378859 0.443712484183} H6 969 -1 14 {} Si 0.0 {0.360394967465 0.459064013371 0.574357008605} Si1 970 -1 8 {} O 0.0 {0.343196372224 0.461017197259 0.568058970299} O1 971 -1 14 {} Si 0.0 {0.337491061545 0.445168301823 0.560619760403} Si2 972 -1 8 {} O 0.0 {0.321015268736 0.440739884526 0.567507998466} O2 973 -1 1 {} H 0.0 {0.32206203749 0.438041842556 0.577584774813} H1 974 -1 8 {} O 0.0 {0.336154967646 0.447087812195 0.542371917382} O3 975 -1 1 {} H 0.0 {0.34494351586 0.451470716248 0.538673055706} H2 976 -1 8 {} O 0.0 {0.34956255083 0.431840364681 0.564524100218} O4 977 -1 1 {} H 0.0 {0.345887840855 0.426017695014 0.57245193945} H3 978 -1 8 {} O 0.0 {0.366731413144 0.475393542421 0.580003891781} O5 979 -1 1 {} H 0.0 {0.363547810277 0.477156494903 0.589852971801} H4 980 -1 8 {} O 0.0 {0.371193105647 0.452631018091 0.560913693085} O6 981 -1 1 {} H 0.0 {0.36531268171 0.447627163754 0.553805307538} H5 982 -1 8 {} O 0.0 {0.360470655408 0.447252289864 0.588467282217} O7 983 -1 1 {} H 0.0 {0.368561129528 0.440637581023 0.58743517516} H6 984 -1 14 {} Si 0.0 {0.352524989675 0.548038148181 0.492985966516} Si1 985 -1 8 {} O 0.0 {0.366888861858 0.548852010929 0.481557796735} O1 986 -1 14 {} Si 0.0 {0.381075324974 0.556655240804 0.490249233399} Si2 987 -1 8 {} O 0.0 {0.39183014696 0.565282173813 0.47803054013} O2 988 -1 1 {} H 0.0 {0.393876006529 0.558837103888 0.470000908837} H1 989 -1 8 {} O 0.0 {0.37477397202 0.568823931475 0.502513859701} O3 990 -1 1 {} H 0.0 {0.371627818065 0.577499389781 0.497514035637} H2 991 -1 8 {} O 0.0 {0.390761596565 0.543669821425 0.498965436263} O4 992 -1 1 {} H 0.0 {0.387158042276 0.534199400668 0.496217692335} H3 993 -1 8 {} O 0.0 {0.345581569824 0.530999329506 0.492964323169} O5 994 -1 1 {} H 0.0 {0.353297227153 0.524087572825 0.491270812192} H4 995 -1 8 {} O 0.0 {0.339632099549 0.55992261351 0.487461792535} O6 996 -1 1 {} H 0.0 {0.330756569909 0.558154779261 0.49277561984} H5 997 -1 8 {} O 0.0 {0.358018736616 0.552405785936 0.509987522954} O7 998 -1 1 {} H 0.0 {0.351928209252 0.56007749819 0.513751045372} H6 999 -1 14 {} Si 0.0 {0.496470733589 0.313044419516 0.635119548045} Si1 1000 -1 8 {} O 0.0 {0.494091537367 0.304136715545 0.651053179533} O1 1001 -1 14 {} Si 0.0 {0.496177530635 0.315867494058 0.665099671048} Si2 1002 -1 8 {} O 0.0 {0.509946123674 0.327513715065 0.661439382477} O2 1003 -1 1 {} H 0.0 {0.518776156995 0.322086815123 0.659802635445} H1 1004 -1 8 {} O 0.0 {0.480619345088 0.32536307862 0.667532865597} O3 1005 -1 1 {} H 0.0 {0.472559636057 0.319942217764 0.663565855083} H2 1006 -1 8 {} O 0.0 {0.506411399291 0.302584246552 0.623701687205} O5 1007 -1 1 {} H 0.0 {0.499983870587 0.297541765342 0.617103142624} H4 1008 -1 8 {} O 0.0 {0.505291378014 0.328900399327 0.63816487703} O6 1009 -1 1 {} H 0.0 {0.498634947703 0.336910304656 0.636822584639} H5 1010 -1 8 {} O 0.0 {0.48006817347 0.316492662573 0.627522510481} O7 1011 -1 1 {} H 0.0 {0.478102448475 0.32679301518 0.627998726421} H6 1012 -1 8 {} O 0.0 {0.654009619057 0.360275071384 0.639561415134} O1 1013 -1 8 {} O 0.0 {0.641608553584 0.385142356149 0.651187990412} O4 1014 -1 1 {} H 0.0 {0.634787886858 0.384520920605 0.659141131992} H3 1015 -1 1 {} H 0.0 {0.641227934467 0.336741701245 0.62268495244} H5 1016 -1 8 {} O 0.0 {0.628072155177 0.34842240119 0.649401524927} O7 1017 -1 1 {} H 0.0 {0.622846509949 0.351372859838 0.640805411157} H6 1018 -1 14 {} Si 0.0 {0.425960409429 0.395724105993 0.296146829115} Si1 1019 -1 8 {} O 0.0 {0.436551195175 0.410475862437 0.29276278533} O1 1020 -1 14 {} Si 0.0 {0.451439823202 0.410064646284 0.303687412515} Si2 1021 -1 8 {} O 0.0 {0.466372057405 0.414708127789 0.29403937053} O2 1022 -1 1 {} H 0.0 {0.472676589291 0.406325644181 0.293164469828} H1 1023 -1 8 {} O 0.0 {0.449235608195 0.42180136589 0.317685643033} O3 1024 -1 1 {} H 0.0 {0.457389009155 0.420934444966 0.324274647639} H2 1025 -1 8 {} O 0.0 {0.453675761812 0.393219872164 0.310270255409} O4 1026 -1 1 {} H 0.0 {0.448398986828 0.386445294302 0.304323320998} H3 1027 -1 8 {} O 0.0 {0.417025617287 0.398111344461 0.312031866487} O5 1028 -1 1 {} H 0.0 {0.406881450395 0.400041711496 0.310059588485} H4 1029 -1 8 {} O 0.0 {0.436544419233 0.380682072325 0.297227522407} O6 1030 -1 1 {} H 0.0 {0.438908623347 0.377324924267 0.287594153076} H5 1031 -1 8 {} O 0.0 {0.413652788594 0.393604386646 0.282580849897} O7 1032 -1 1 {} H 0.0 {0.404047259272 0.392664595029 0.286685469436} H6 1033 -1 14 {} Si 0.0 {0.517352118075 0.641814540517 0.488202492204} Si1 1034 -1 8 {} O 0.0 {0.500385116164 0.634856654258 0.486959752804} O1 1035 -1 14 {} Si 0.0 {0.490884695093 0.639444511446 0.501995027705} Si2 1036 -1 8 {} O 0.0 {0.495057086139 0.627848428278 0.515667179321} O2 1037 -1 1 {} H 0.0 {0.499085748022 0.619025400125 0.51164300075} H1 1038 -1 8 {} O 0.0 {0.495259662079 0.656617237244 0.506972537062} O3 1039 -1 1 {} H 0.0 {0.500955495227 0.661097626908 0.499376281549} H2 1040 -1 8 {} O 0.0 {0.472868059989 0.638497345728 0.498421329055} O4 1041 -1 1 {} H 0.0 {0.469762404106 0.628477134729 0.498807240836} H3 1042 -1 8 {} O 0.0 {0.516928905255 0.659756740838 0.484148500188} O5 1043 -1 1 {} H 0.0 {0.516627035047 0.665340029661 0.49303619552} H4 1044 -1 8 {} O 0.0 {0.52843938484 0.633103594559 0.476404037467} O6 1045 -1 1 {} H 0.0 {0.526141334671 0.622861885722 0.476365252537} H5 1046 -1 8 {} O 0.0 {0.523626105814 0.639551527588 0.505356683093} O7 1047 -1 1 {} H 0.0 {0.534110939625 0.640022800851 0.505323074767} H6 1048 -1 14 {} Si 0.0 {0.349626576234 0.444954974515 0.309750891163} Si1 1049 -1 8 {} O 0.0 {0.345805487474 0.451313905074 0.326588119485} O5 1050 -1 1 {} H 0.0 {0.354019889159 0.449657502971 0.332903541084} H4 1051 -1 8 {} O 0.0 {0.363587995318 0.454578748772 0.302630246948} O6 1052 -1 1 {} H 0.0 {0.369992985086 0.448100821074 0.29743162538} H5 1053 -1 8 {} O 0.0 {0.354304468754 0.427197226684 0.310816903925} O7 1054 -1 1 {} H 0.0 {0.34693824688 0.421370223974 0.306123699702} H6 1055 -1 14 {} Si 0.0 {0.483133219678 0.554729790499 0.548014854736} Si1 1056 -1 8 {} O 0.0 {0.499704374549 0.555625717276 0.556094681997} O1 1057 -1 14 {} Si 0.0 {0.512855175637 0.550956632135 0.544059653528} Si2 1058 -1 8 {} O 0.0 {0.520203087348 0.566170042216 0.536790664909} O2 1059 -1 1 {} H 0.0 {0.512734794357 0.573460348157 0.53569192223} H1 1060 -1 8 {} O 0.0 {0.525970977447 0.54139097502 0.552748471972} O3 1061 -1 1 {} H 0.0 {0.535009047041 0.54227384649 0.547484152428} H2 1062 -1 8 {} O 0.0 {0.505604656869 0.540643559629 0.53066110632} O4 1063 -1 1 {} H 0.0 {0.497309926539 0.545592304661 0.526563089088} H3 1064 -1 8 {} O 0.0 {0.483097590823 0.541456996743 0.535232692971} O5 1065 -1 1 {} H 0.0 {0.477260477298 0.533387599762 0.538587078264} H4 1066 -1 8 {} O 0.0 {0.479290606416 0.570862263964 0.540074485009} O6 1067 -1 1 {} H 0.0 {0.484159225664 0.578559123882 0.545282552839} H5 1068 -1 8 {} O 0.0 {0.470383226855 0.550967600008 0.560746158292} O7 1069 -1 1 {} H 0.0 {0.462773053685 0.558178905237 0.560299347855} H6 1070 -1 14 {} Si 0.0 {0.293328136883 0.387535957832 0.432198243971} Si1 1071 -1 8 {} O 0.0 {0.307270223203 0.375510505587 0.431653397213} O1 1072 -1 14 {} Si 0.0 {0.31345997215 0.37218153081 0.448708261086} Si2 1073 -1 8 {} O 0.0 {0.320944220007 0.387471231071 0.455650032013} O2 1074 -1 1 {} H 0.0 {0.328243543685 0.391080955888 0.449045501205} H1 1075 -1 8 {} O 0.0 {0.299510735619 0.36674969215 0.4594783672} O3 1076 -1 1 {} H 0.0 {0.290454596523 0.370332947012 0.455579533889} H2 1077 -1 8 {} O 0.0 {0.326198069471 0.358927361653 0.448026783112} O4 1078 -1 1 {} H 0.0 {0.335291562709 0.362988964965 0.444683723695} H3 1079 -1 8 {} O 0.0 {0.299432929583 0.403772583528 0.438323622697} O5 1080 -1 1 {} H 0.0 {0.306714487504 0.407473974986 0.431733406078} H4 1081 -1 8 {} O 0.0 {0.280203090356 0.381270823062 0.443466007933} O6 1082 -1 1 {} H 0.0 {0.274207397226 0.389293616433 0.446634078086} H5 1083 -1 8 {} O 0.0 {0.286412941076 0.389589673543 0.415268863542} O7 1084 -1 8 {} O 0.0 {0.39050618571 0.561988134276 0.284808500608} O2 1085 -1 1 {} H 0.0 {0.383193384369 0.568018533371 0.289320001701} H1 1086 -1 1 {} H 0.0 {0.410874246945 0.583313758924 0.282737024138} H3 1087 -1 1 {} H 0.0 {0.738728462888 0.49880293247 0.540534593562} H4 1088 -1 8 {} O 0.0 {0.265450819426 0.553942159779 0.454168541457} O1 1089 -1 8 {} O 0.0 {0.263454690892 0.524370653895 0.449515691942} O6 1090 -1 1 {} H 0.0 {0.267577439694 0.522266794379 0.440089773254} H5 1091 -1 14 {} Si 0.0 {0.511644474313 0.665353949028 0.571976933049} Si1 1092 -1 8 {} O 0.0 {0.523364119139 0.678103358799 0.56546407791} O1 1093 -1 14 {} Si 0.0 {0.526915964579 0.690392911198 0.57875117554} Si2 1094 -1 8 {} O 0.0 {0.522240528774 0.683114179953 0.595007961352} O2 1095 -1 1 {} H 0.0 {0.513236021254 0.677759334992 0.59397492093} H1 1096 -1 8 {} O 0.0 {0.544822423223 0.694499851978 0.578785885434} O3 1097 -1 1 {} H 0.0 {0.549981289356 0.687577922944 0.572842791504} H2 1098 -1 8 {} O 0.0 {0.517081168099 0.705734919286 0.575833456691} O4 1099 -1 1 {} H 0.0 {0.507649148522 0.703186924328 0.571991421443} H3 1100 -1 8 {} O 0.0 {0.507268911901 0.65362163105 0.558654597492} O5 1101 -1 1 {} H 0.0 {0.510135670874 0.643980775488 0.561580368254} H4 1102 -1 8 {} O 0.0 {0.496386155503 0.67357331633 0.578173109297} O6 1103 -1 1 {} H 0.0 {0.492039087582 0.667656826598 0.585680480148} H5 1104 -1 8 {} O 0.0 {0.51961502956 0.65612331141 0.585730574089} O7 1105 -1 1 {} H 0.0 {0.513722472975 0.656963496522 0.594364582078} H6 1106 -1 8 {} O 0.0 {0.543084369223 0.260291517723 0.441468544369} O3 1107 -1 1 {} H 0.0 {0.545134344543 0.265479682452 0.432604887823} H2 1108 -1 14 {} Si 0.0 {0.602388092552 0.43727531084 0.56706065011} Si1 1109 -1 8 {} O 0.0 {0.603583121332 0.455566077018 0.568303696313} O1 1110 -1 14 {} Si 0.0 {0.62107377669 0.460535655913 0.565604482573} Si2 1111 -1 8 {} O 0.0 {0.621640010492 0.477332418112 0.558078188153} O2 1112 -1 1 {} H 0.0 {0.630707805994 0.478529626138 0.55289843988} H1 1113 -1 8 {} O 0.0 {0.629954037401 0.460627765075 0.581731598864} O3 1114 -1 1 {} H 0.0 {0.623068934434 0.459211014017 0.589522539248} H2 1115 -1 8 {} O 0.0 {0.629125175195 0.448490128251 0.55429466142} O4 1116 -1 1 {} H 0.0 {0.639173639931 0.451177857427 0.552925428484} H3 1117 -1 8 {} O 0.0 {0.588353120865 0.432720277819 0.556061808155} O5 1118 -1 1 {} H 0.0 {0.586969184188 0.440238549897 0.548868205697} H4 1119 -1 8 {} O 0.0 {0.599674137626 0.430125841343 0.583773285053} O6 1120 -1 1 {} H 0.0 {0.603868063729 0.420501878033 0.584153414293} H5 1121 -1 8 {} O 0.0 {0.618061787032 0.430667689788 0.560107305196} O7 1122 -1 1 {} H 0.0 {0.625966664033 0.432818917535 0.566686164256} H6 1123 -1 14 {} Si 0.0 {0.641580867003 0.479390989446 0.605944418101} Si1 1124 -1 8 {} O 0.0 {0.655585155101 0.481795605357 0.617669853498} O1 1125 -1 14 {} Si 0.0 {0.655298983518 0.499051038527 0.624067154095} Si2 1126 -1 8 {} O 0.0 {0.67245811349 0.505491223843 0.625038803883} O2 1127 -1 1 {} H 0.0 {0.679171378912 0.497854453811 0.622464094895} H1 1128 -1 8 {} O 0.0 {0.645371342065 0.509599880623 0.61273432892} O3 1129 -1 1 {} H 0.0 {0.645882366988 0.505686123484 0.603006523105} H2 1130 -1 8 {} O 0.0 {0.647791355834 0.499348925621 0.64081528275} O4 1131 -1 1 {} H 0.0 {0.655374742961 0.498672836049 0.648055010684} H3 1132 -1 8 {} O 0.0 {0.648005894124 0.479412931017 0.588714553424} O5 1133 -1 1 {} H 0.0 {0.648452172076 0.469550751379 0.585154795482} H4 1134 -1 8 {} O 0.0 {0.629449675715 0.493097722156 0.60795749899} O6 1135 -1 1 {} H 0.0 {0.623842155046 0.491542713327 0.616696637367} H5 1136 -1 8 {} O 0.0 {0.633298257754 0.463308566944 0.609402356749} O7 1137 -1 1 {} H 0.0 {0.624646548519 0.464979427667 0.61512594572} H6 1138 -1 14 {} Si 0.0 {0.31870636948 0.518628755088 0.62371714185} Si1 1139 -1 8 {} O 0.0 {0.328450554715 0.509558630218 0.63644755705} O1 1140 -1 14 {} Si 0.0 {0.346483587727 0.512340379764 0.633805659923} Si2 1141 -1 8 {} O 0.0 {0.349347650486 0.529514715822 0.627750415166} O2 1142 -1 1 {} H 0.0 {0.343917686455 0.536272866612 0.633663614609} H1 1143 -1 8 {} O 0.0 {0.355360584073 0.509823220358 0.649691358739} O3 1144 -1 1 {} H 0.0 {0.34931529435 0.50424832358 0.656226647119} H2 1145 -1 8 {} O 0.0 {0.352859438619 0.500348281825 0.621408291919} O4 1146 -1 1 {} H 0.0 {0.344921561929 0.496829123785 0.615559925582} H3 1147 -1 8 {} O 0.0 {0.301220691723 0.512901719237 0.624219487571} O5 1148 -1 1 {} H 0.0 {0.29497769389 0.520959942202 0.626738042572} H4 1149 -1 8 {} O 0.0 {0.325744543057 0.515313944096 0.607044025075} O6 1150 -1 1 {} H 0.0 {0.331188746893 0.523686667044 0.603828068394} H5 1151 -1 8 {} O 0.0 {0.319313209325 0.536688368682 0.6271958983} O7 1152 -1 1 {} H 0.0 {0.326220548711 0.541254506598 0.620755035957} H6 1153 -1 14 {} Si 0.0 {0.536586663726 0.41847751523 0.484283624508} Si1 1154 -1 8 {} O 0.0 {0.523098330802 0.428596104139 0.476928697954} O1 1155 -1 14 {} Si 0.0 {0.529906838646 0.43958800078 0.463814715231} Si2 1156 -1 8 {} O 0.0 {0.522016271217 0.456171034586 0.465046504029} O2 1157 -1 1 {} H 0.0 {0.512997060958 0.45615007421 0.459664026495} H1 1158 -1 8 {} O 0.0 {0.548108081394 0.441291574066 0.465960465582} O3 1159 -1 1 {} H 0.0 {0.551085859086 0.450918807752 0.462971193084} H2 1160 -1 8 {} O 0.0 {0.526327991884 0.43232719329 0.447299894655} O4 1161 -1 1 {} H 0.0 {0.521551000668 0.423057385382 0.448531766469} H3 1162 -1 8 {} O 0.0 {0.533908437 0.400771053882 0.480100284028} O5 1163 -1 1 {} H 0.0 {0.540542907459 0.39794805967 0.472493023874} H4 1164 -1 8 {} O 0.0 {0.536474222223 0.420523137172 0.502556025882} O6 1165 -1 1 {} H 0.0 {0.527667898529 0.425455492681 0.505451737881} H5 1166 -1 8 {} O 0.0 {0.552819682814 0.423986602792 0.477602609971} O7 1167 -1 1 {} H 0.0 {0.559959796156 0.423905623383 0.48530877426} H6 1168 -1 14 {} Si 0.0 {0.607109423466 0.705587298097 0.453927409319} Si2 1169 -1 8 {} O 0.0 {0.59172547463 0.714792916466 0.458059391596} O2 1170 -1 1 {} H 0.0 {0.584401732457 0.708034523567 0.461370366217} H1 1171 -1 8 {} O 0.0 {0.604607855553 0.696182879725 0.438316909214} O3 1172 -1 1 {} H 0.0 {0.613806953555 0.695134995236 0.433378204575} H2 1173 -1 8 {} O 0.0 {0.611087310284 0.693886031773 0.467553332652} O4 1174 -1 1 {} H 0.0 {0.603236661848 0.687002620642 0.468646191934} H3 1175 -1 14 {} Si 0.0 {0.467083435686 0.378316759632 0.308756569404} Si1 1176 -1 8 {} O 0.0 {0.476755835873 0.39393494 0.307520502246} O1 1177 -1 14 {} Si 0.0 {0.490824934902 0.391376205589 0.295907619097} Si2 1178 -1 8 {} O 0.0 {0.485200006033 0.381067856853 0.281734259993} O2 1179 -1 1 {} H 0.0 {0.493331321742 0.379111823338 0.275396102004} H1 1180 -1 8 {} O 0.0 {0.496788753797 0.407643360636 0.289688840452} O3 1181 -1 1 {} H 0.0 {0.488564075952 0.413702468894 0.287296146302} H2 1182 -1 8 {} O 0.0 {0.504529633255 0.382780258805 0.304676136106} O4 1183 -1 1 {} H 0.0 {0.505393801041 0.372970777375 0.301035727223} H3 1184 -1 8 {} O 0.0 {0.462164814895 0.372875262079 0.291896227666} O5 1185 -1 1 {} H 0.0 {0.469327616673 0.366178701845 0.28816688438} H4 1186 -1 8 {} O 0.0 {0.451951714338 0.381071337714 0.318935338617} O6 1187 -1 1 {} H 0.0 {0.452668124871 0.375716122031 0.327756014104} H5 1188 -1 8 {} O 0.0 {0.477487068038 0.365344605599 0.316581357428} O7 1189 -1 1 {} H 0.0 {0.471497539707 0.357090285534 0.319024289298} H6 1190 -1 1 {} H 0.0 {0.51593224192 0.679621811933 0.643005322633} H3 1191 -1 8 {} O 0.0 {0.529048707468 0.689826442385 0.62936298195} O5 1192 -1 1 {} H 0.0 {0.526889006219 0.697587455707 0.622644522863} H4 1193 -1 8 {} O 0.0 {0.503829918761 0.497721379185 0.736586332682} O5 1194 -1 1 {} H 0.0 {0.509395466277 0.504570241463 0.742270432769} H4 1195 -1 8 {} O 0.0 {0.489672781778 0.471235518864 0.737430208967} O6 1196 -1 1 {} H 0.0 {0.495064473534 0.463821725444 0.732310050379} H5 1197 -1 1 {} H 0.0 {0.521237705576 0.470975475969 0.738915278889} H6 1198 -1 14 {} Si 0.0 {0.356594981316 0.510913511907 0.695850235184} Si1 1199 -1 8 {} O 0.0 {0.379177576395 0.490859066596 0.702305341845} O2 1200 -1 1 {} H 0.0 {0.376767140196 0.482038828102 0.69714741278} H1 1201 -1 8 {} O 0.0 {0.367080641004 0.498799441836 0.686862591499} O6 1202 -1 1 {} H 0.0 {0.377119171909 0.501773921886 0.687476829091} H5 1203 -1 8 {} O 0.0 {0.363493348461 0.527810369957 0.693604392758} O7 1204 -1 1 {} H 0.0 {0.368256075596 0.528416504787 0.684281075628} H6 1205 -1 14 {} Si 0.0 {0.499331080038 0.387126604936 0.60350870955} Si1 1206 -1 8 {} O 0.0 {0.484037297447 0.378082169676 0.598832443138} O1 1207 -1 14 {} Si 0.0 {0.477041846198 0.370028934538 0.613800214535} Si2 1208 -1 8 {} O 0.0 {0.477062347768 0.351772448607 0.611536971351} O2 1209 -1 1 {} H 0.0 {0.468518436251 0.348912429502 0.606155273391} H1 1210 -1 8 {} O 0.0 {0.487287835493 0.374405953794 0.628428446101} O3 1211 -1 1 {} H 0.0 {0.484079603444 0.383620252438 0.632306243442} H2 1212 -1 8 {} O 0.0 {0.459808918423 0.375883899864 0.616423934558} O4 1213 -1 1 {} H 0.0 {0.453618633622 0.367665763314 0.61846702264} H3 1214 -1 8 {} O 0.0 {0.494821926258 0.403336875822 0.610947660194} O5 1215 -1 1 {} H 0.0 {0.491003107525 0.401789895231 0.620609854522} H4 1216 -1 8 {} O 0.0 {0.509669426569 0.389890408923 0.588541813249} O6 1217 -1 1 {} H 0.0 {0.519745258702 0.388096950532 0.590892295713} H5 1218 -1 8 {} O 0.0 {0.508782210837 0.377180085122 0.615754998423} O7 1219 -1 1 {} H 0.0 {0.51899027612 0.379466718158 0.61497540583} H6 1220 -1 1 {} H 0.0 {0.365113530945 0.465861174927 0.70181350657} H1 1221 -1 8 {} O 0.0 {0.398520210307 0.424311672174 0.709315864567} O5 1222 -1 1 {} H 0.0 {0.404320421951 0.43263247069 0.706592208683} H4 1223 -1 8 {} O 0.0 {0.372493843919 0.429032877787 0.695086081329} O6 1224 -1 14 {} Si 0.0 {0.53776591748 0.686766204781 0.544733915739} Si1 1225 -1 8 {} O 0.0 {0.520339012052 0.681872849476 0.547839777096} O1 1226 -1 14 {} Si 0.0 {0.512522254918 0.694490852419 0.558575656025} Si2 1227 -1 8 {} O 0.0 {0.524606187768 0.708056433759 0.561667618969} O2 1228 -1 1 {} H 0.0 {0.533366824063 0.704043786969 0.565859832312} H1 1229 -1 8 {} O 0.0 {0.497689269269 0.701283510196 0.550180802735} O3 1230 -1 1 {} H 0.0 {0.489496157604 0.694967599639 0.551990738035} H2 1231 -1 8 {} O 0.0 {0.507400136295 0.686878832819 0.574618554052} O4 1232 -1 1 {} H 0.0 {0.514672145186 0.680088007788 0.577840841634} H3 1233 -1 8 {} O 0.0 {0.539484799857 0.704928707297 0.546999638545} O5 1234 -1 1 {} H 0.0 {0.544978743675 0.706840143767 0.555754010165} H4 1235 -1 8 {} O 0.0 {0.542491671167 0.682221604324 0.527535955171} O6 1236 -1 1 {} H 0.0 {0.534858459005 0.685145253589 0.520936146602} H5 1237 -1 8 {} O 0.0 {0.548726596022 0.678124853545 0.556664777371} O7 1238 -1 1 {} H 0.0 {0.543057888522 0.671333777723 0.562311997191} H6 1239 -1 8 {} O 0.0 {0.637955201551 0.69111546272 0.523695176491} O2 1240 -1 8 {} O 0.0 {0.667184941635 0.659733011825 0.526519346795} O5 1241 -1 1 {} H 0.0 {0.663298722157 0.652547671656 0.519932785553} H4 1242 -1 8 {} O 0.0 {0.647269629539 0.677573961961 0.512843726504} O7 1243 -1 1 {} H 0.0 {0.647520188972 0.68217473873 0.503411056693} H6 1244 -1 14 {} Si 0.0 {0.432558169344 0.300845137999 0.373233246435} Si1 1245 -1 8 {} O 0.0 {0.445858847666 0.299412536799 0.360632170499} O1 1246 -1 14 {} Si 0.0 {0.441555418197 0.309687030247 0.345965073923} Si2 1247 -1 8 {} O 0.0 {0.434640821025 0.325796248442 0.351562564093} O2 1248 -1 1 {} H 0.0 {0.433770856486 0.325794840717 0.362017014183} H1 1249 -1 8 {} O 0.0 {0.456691399085 0.312662663867 0.335987405654} O3 1250 -1 1 {} H 0.0 {0.465024552333 0.313167149947 0.3423457554} H2 1251 -1 8 {} O 0.0 {0.436407211181 0.314723394113 0.384687276714} O5 1252 -1 1 {} H 0.0 {0.432860821575 0.323712379673 0.380571181595} H4 1253 -1 8 {} O 0.0 {0.431441058112 0.285149469771 0.382778550734} O6 1254 -1 8 {} O 0.0 {0.416521639921 0.304058094582 0.36490738178} O7 1255 -1 1 {} H 0.0 {0.408718949417 0.300611942241 0.370989420422} H6 1256 -1 14 {} Si 0.0 {0.34594883919 0.517290590064 0.55844782} Si1 1257 -1 8 {} O 0.0 {0.338724083029 0.530725445197 0.548158444318} O1 1258 -1 14 {} Si 0.0 {0.350224389084 0.534773079008 0.534394191626} Si2 1259 -1 8 {} O 0.0 {0.366331037059 0.52632089199 0.53715713946} O2 1260 -1 1 {} H 0.0 {0.373891583743 0.533503294014 0.538297526498} H1 1261 -1 8 {} O 0.0 {0.342949253558 0.529146769686 0.518453005526} O3 1262 -1 1 {} H 0.0 {0.332506423813 0.530248629578 0.518809028454} H2 1263 -1 8 {} O 0.0 {0.352910822126 0.552916585952 0.53380757855} O4 1264 -1 1 {} H 0.0 {0.344778691075 0.557800070805 0.538277804704} H3 1265 -1 8 {} O 0.0 {0.336434037581 0.515716182194 0.574146984871} O5 1266 -1 1 {} H 0.0 {0.329888664984 0.523880656805 0.575128539927} H4 1267 -1 8 {} O 0.0 {0.363489172499 0.521255410972 0.562281528615} O6 1268 -1 1 {} H 0.0 {0.3696972806 0.513813433764 0.558259367271} H5 1269 -1 8 {} O 0.0 {0.345135150337 0.501411170758 0.549201338624} O7 1270 -1 1 {} H 0.0 {0.352604874922 0.494939080981 0.55272745229} H6 1271 -1 14 {} Si 0.0 {0.594265317274 0.651911130518 0.433669245656} Si1 1272 -1 8 {} O 0.0 {0.596963229169 0.641776863315 0.418557887453} O1 1273 -1 14 {} Si 0.0 {0.615011024904 0.639171398865 0.416221106061} Si2 1274 -1 8 {} O 0.0 {0.623736252703 0.655246511092 0.417911065438} O2 1275 -1 1 {} H 0.0 {0.617479240107 0.662974709323 0.414535917302} H1 1276 -1 8 {} O 0.0 {0.62122254983 0.627456141401 0.428973785434} O3 1277 -1 1 {} H 0.0 {0.615209680644 0.628132872907 0.437547834845} H2 1278 -1 8 {} O 0.0 {0.618144486813 0.632242799695 0.399491990892} O4 1279 -1 1 {} H 0.0 {0.61481273108 0.639041487864 0.392213840526} H3 1280 -1 8 {} O 0.0 {0.593718454063 0.640903994625 0.448393101417} O5 1281 -1 1 {} H 0.0 {0.599885416706 0.632566735235 0.446743449784} H4 1282 -1 8 {} O 0.0 {0.578352491703 0.661039405062 0.432233593138} O6 1283 -1 1 {} H 0.0 {0.57452923576 0.659879144905 0.422529852147} H5 1284 -1 8 {} O 0.0 {0.608080351172 0.663923191403 0.435518250908} O7 1285 -1 1 {} H 0.0 {0.607740908931 0.670865445992 0.427648665498} H6 1286 -1 14 {} Si 0.0 {0.55143435334 0.40732673234 0.711000059268} Si1 1287 -1 8 {} O 0.0 {0.565198180108 0.417946314095 0.705090530042} O1 1288 -1 14 {} Si 0.0 {0.560022012238 0.426385023893 0.689670376781} Si2 1289 -1 8 {} O 0.0 {0.551520489209 0.414340591187 0.67866762509} O2 1290 -1 1 {} H 0.0 {0.554167943489 0.404578230202 0.681487133423} H1 1291 -1 8 {} O 0.0 {0.54848017525 0.440047859335 0.693859994594} O3 1292 -1 1 {} H 0.0 {0.550861849581 0.443831520878 0.703364831016} H2 1293 -1 8 {} O 0.0 {0.574818661338 0.433154509975 0.681094809836} O4 1294 -1 1 {} H 0.0 {0.579180635508 0.425624403164 0.67520721532} H3 1295 -1 8 {} O 0.0 {0.54539005281 0.413485079806 0.727309990671} O5 1296 -1 8 {} O 0.0 {0.557458232776 0.390016207985 0.712746242867} O6 1297 -1 1 {} H 0.0 {0.555108605246 0.384619110062 0.704057919321} H5 1298 -1 8 {} O 0.0 {0.537637722029 0.40781144951 0.698845632284} O7 1299 -1 1 {} H 0.0 {0.529534023644 0.402252067912 0.702556154056} H6 1300 -1 14 {} Si 0.0 {0.633814079235 0.539680849988 0.294229213215} Si2 1301 -1 8 {} O 0.0 {0.641907459361 0.553287230849 0.303557880844} O3 1302 -1 1 {} H 0.0 {0.636514060115 0.555118242163 0.31236866022} H2 1303 -1 8 {} O 0.0 {0.625228033868 0.528525993666 0.306051201781} O4 1304 -1 1 {} H 0.0 {0.614838570412 0.529784770591 0.305097497062} H3 1305 -1 1 {} H 0.0 {0.551584414057 0.646883969616 0.674554026649} H1 1306 -1 1 {} H 0.0 {0.527736061414 0.666916543442 0.661834788161} H3 1307 -1 14 {} Si 0.0 {0.564303184529 0.38119387154 0.520906940668} Si1 1308 -1 8 {} O 0.0 {0.573769693613 0.377981812912 0.536329971024} O1 1309 -1 14 {} Si 0.0 {0.590765116521 0.384675393825 0.534362836415} Si2 1310 -1 8 {} O 0.0 {0.593398426476 0.398372174761 0.546348060061} O2 1311 -1 1 {} H 0.0 {0.591650921462 0.407554285912 0.541560813872} H1 1312 -1 8 {} O 0.0 {0.603030919703 0.37134456685 0.537458473053} O3 1313 -1 1 {} H 0.0 {0.601932759501 0.36384513417 0.530188851506} H2 1314 -1 8 {} O 0.0 {0.592839779 0.391031391075 0.517250288162} O4 1315 -1 1 {} H 0.0 {0.584372774775 0.396628095722 0.514575243191} H3 1316 -1 8 {} O 0.0 {0.546814173718 0.375983311749 0.523210199302} O5 1317 -1 1 {} H 0.0 {0.540988447641 0.384362847154 0.52568545393} H4 1318 -1 8 {} O 0.0 {0.571789840465 0.371681379511 0.507055052363} O6 1319 -1 1 {} H 0.0 {0.578731518423 0.377747806075 0.502020547584} H5 1320 -1 8 {} O 0.0 {0.564892792563 0.39915395673 0.517019504509} O7 1321 -1 1 {} H 0.0 {0.568132121482 0.404445574231 0.525489244304} H6 1322 -1 14 {} Si 0.0 {0.616877312145 0.579445293183 0.574264479072} Si1 1323 -1 8 {} O 0.0 {0.621624915908 0.58234937916 0.556704629592} O1 1324 -1 14 {} Si 0.0 {0.639220419795 0.577513270441 0.554258778328} Si2 1325 -1 8 {} O 0.0 {0.640059292772 0.560016275423 0.548636962002} O2 1326 -1 1 {} H 0.0 {0.648968065959 0.555663552156 0.55208773627} H1 1327 -1 8 {} O 0.0 {0.646947469412 0.588394425849 0.541566151686} O3 1328 -1 1 {} H 0.0 {0.639811389886 0.595218031556 0.538002173592} H2 1329 -1 8 {} O 0.0 {0.648303411429 0.579262607831 0.570165230683} O4 1330 -1 1 {} H 0.0 {0.657668394427 0.574593573213 0.569368672478} H3 1331 -1 8 {} O 0.0 {0.631870743646 0.580410306369 0.584883716438} O5 1332 -1 1 {} H 0.0 {0.630446833478 0.587744014018 0.592259539996} H4 1333 -1 8 {} O 0.0 {0.609284294964 0.562753840723 0.575920667994} O6 1334 -1 1 {} H 0.0 {0.601583722757 0.56170597103 0.568860367017} H5 1335 -1 8 {} O 0.0 {0.604782792498 0.592258285211 0.579600241316} O7 1336 -1 1 {} H 0.0 {0.597210051768 0.593135028379 0.572382769536} H6 1337 -1 14 {} Si 0.0 {0.554505778409 0.482649659096 0.546418178961} Si1 1338 -1 8 {} O 0.0 {0.55177305729 0.478608850433 0.564182722775} O1 1339 -1 14 {} Si 0.0 {0.535275147253 0.470720079853 0.56628355326} Si2 1340 -1 8 {} O 0.0 {0.524958971865 0.473998723056 0.551414880236} O2 1341 -1 1 {} H 0.0 {0.528045987076 0.467738227618 0.54357880068} H1 1342 -1 8 {} O 0.0 {0.537356483186 0.452559401338 0.568414139729} O3 1343 -1 1 {} H 0.0 {0.547363126723 0.44996144802 0.566599572981} H2 1344 -1 8 {} O 0.0 {0.526993768592 0.477713542868 0.581158724393} O4 1345 -1 1 {} H 0.0 {0.533943841146 0.483292822349 0.586716192268} H3 1346 -1 8 {} O 0.0 {0.539701461775 0.491268840363 0.539682967187} O5 1347 -1 1 {} H 0.0 {0.53342144666 0.494119042057 0.547590470754} H4 1348 -1 8 {} O 0.0 {0.557389728552 0.467134401055 0.536963028157} O6 1349 -1 1 {} H 0.0 {0.5675437784 0.466472328151 0.534368506146} H5 1350 -1 8 {} O 0.0 {0.56920812906 0.493595247605 0.54483380016} O7 1351 -1 1 {} H 0.0 {0.577302148435 0.48804316586 0.54110289681} H6 1352 -1 8 {} O 0.0 {0.404176054649 0.65183995292 0.646270006681} O3 1353 -1 1 {} H 0.0 {0.394341994897 0.654453434272 0.648880042422} H2 1354 -1 8 {} O 0.0 {0.433134378707 0.658896016519 0.650255635481} O4 1355 -1 1 {} H 0.0 {0.439028158119 0.667590300193 0.65057931286} H3 1356 -1 14 {} Si 0.0 {0.45792490305 0.494006981363 0.415122878052} Si1 1357 -1 8 {} O 0.0 {0.447292911232 0.494844448694 0.430084107947} O1 1358 -1 14 {} Si 0.0 {0.433140523183 0.506090088692 0.426786022678} Si2 1359 -1 8 {} O 0.0 {0.42626147009 0.502492196975 0.41008391496} O2 1360 -1 1 {} H 0.0 {0.432906785818 0.496304155779 0.404829844056} H1 1361 -1 8 {} O 0.0 {0.4200864083 0.503439382613 0.439522544905} O3 1362 -1 1 {} H 0.0 {0.424264819167 0.504501951422 0.449087245745} H2 1363 -1 8 {} O 0.0 {0.438881155913 0.52353014234 0.427390743658} O4 1364 -1 1 {} H 0.0 {0.446419090626 0.524954389584 0.420229213175} H3 1365 -1 8 {} O 0.0 {0.447776511372 0.488847713882 0.400640845762} O5 1366 -1 1 {} H 0.0 {0.446300853777 0.497081214638 0.394278529089} H4 1367 -1 8 {} O 0.0 {0.471396019402 0.481771046134 0.417829198819} O6 1368 -1 1 {} H 0.0 {0.480293044549 0.486836534236 0.420151517879} H5 1369 -1 8 {} O 0.0 {0.465241591247 0.510581569585 0.411897543833} O7 1370 -1 1 {} H 0.0 {0.462536097822 0.517152126204 0.419630842329} H6 1371 -1 8 {} O 0.0 {0.380277668498 0.692733298879 0.430804362581} O5 1372 -1 1 {} H 0.0 {0.36379894378 0.694149530033 0.462829003351} H5 1373 -1 8 {} O 0.0 {0.390752225445 0.703141448545 0.457004999163} O7 1374 -1 1 {} H 0.0 {0.38803489965 0.708184533727 0.465823158033} H6 1375 -1 14 {} Si 0.0 {0.490530563649 0.692218216416 0.352060646793} Si1 1376 -1 8 {} O 0.0 {0.48871870861 0.67430515783 0.355842131326} O5 1377 -1 1 {} H 0.0 {0.496465949376 0.671295845005 0.362259766352} H4 1378 -1 14 {} Si 0.0 {0.609013524883 0.426280594556 0.349831719321} Si1 1379 -1 8 {} O 0.0 {0.619671838553 0.418983862925 0.362921648011} O1 1380 -1 14 {} Si 0.0 {0.611372736345 0.420853214784 0.379233160898} Si2 1381 -1 8 {} O 0.0 {0.593496266466 0.416864785407 0.377492700626} O2 1382 -1 1 {} H 0.0 {0.590452451394 0.418726638933 0.367616380683} H1 1383 -1 8 {} O 0.0 {0.61906294223 0.409386747016 0.391389712656} O3 1384 -1 1 {} H 0.0 {0.629459162314 0.409236494725 0.389945748226} H2 1385 -1 8 {} O 0.0 {0.613247263744 0.438186934806 0.385111442921} O4 1386 -1 1 {} H 0.0 {0.621619952429 0.442541750033 0.380511454761} H3 1387 -1 8 {} O 0.0 {0.598600118579 0.439512715728 0.357133867634} O5 1388 -1 1 {} H 0.0 {0.597001906599 0.447040346632 0.350009934542} H4 1389 -1 8 {} O 0.0 {0.598210887773 0.413203367149 0.342718229996} O6 1390 -1 1 {} H 0.0 {0.603987635224 0.404710207157 0.340555799854} H5 1391 -1 8 {} O 0.0 {0.619556263186 0.43344059999 0.336579934554} O7 1392 -1 1 {} H 0.0 {0.623478999561 0.425702192964 0.330688110866} H6 1393 -1 1 {} H 0.0 {0.493557992234 0.728060154276 0.450387279582} H1 1394 -1 8 {} O 0.0 {0.484783171487 0.719588754157 0.418774338643} O4 1395 -1 1 {} H 0.0 {0.484663429695 0.711412912333 0.425378107361} H3 1396 -1 8 {} O 0.0 {0.516387172978 0.715934584403 0.450426630971} O5 1397 -1 1 {} H 0.0 {0.524730227426 0.714202878014 0.456543731975} H4 1398 -1 1 {} H 0.0 {0.685249373478 0.434979883657 0.346338993923} H1 1399 -1 8 {} O 0.0 {0.673431100287 0.45988251752 0.328975028736} O3 1400 -1 1 {} H 0.0 {0.674312649626 0.468820418667 0.33445050101} H2 1401 -1 14 {} Si 0.0 {0.653509542264 0.452176762319 0.470902956561} Si1 1402 -1 8 {} O 0.0 {0.65347752145 0.469791434363 0.476024628907} O1 1403 -1 14 {} Si 0.0 {0.636185526549 0.474642348545 0.479732090954} Si2 1404 -1 8 {} O 0.0 {0.629978797492 0.485906941868 0.466584932225} O2 1405 -1 1 {} H 0.0 {0.628522208777 0.49548797007 0.470611625653} H1 1406 -1 8 {} O 0.0 {0.625741473747 0.459533424676 0.480263015824} O3 1407 -1 1 {} H 0.0 {0.63023227488 0.452424247735 0.486572678921} H2 1408 -1 8 {} O 0.0 {0.635494609997 0.483156160305 0.496009111845} O4 1409 -1 1 {} H 0.0 {0.63027765545 0.492202142378 0.49498590834} H3 1410 -1 8 {} O 0.0 {0.636277706391 0.44580950973 0.471140396495} O5 1411 -1 1 {} H 0.0 {0.633179084269 0.443773038406 0.461370787942} H4 1412 -1 8 {} O 0.0 {0.663483033295 0.442380697013 0.482640240062} O6 1413 -1 1 {} H 0.0 {0.657019638121 0.43735435769 0.489110041997} H5 1414 -1 8 {} O 0.0 {0.660491887071 0.450648584404 0.453947864262} O7 1415 -1 1 {} H 0.0 {0.665637882662 0.441542320323 0.453098417712} H6 1416 -1 14 {} Si 0.0 {0.565597620292 0.373445615922 0.666308770491} Si1 1417 -1 8 {} O 0.0 {0.550832806493 0.376638305843 0.655873181792} O1 1418 -1 14 {} Si 0.0 {0.554501869205 0.371440737289 0.638653805262} Si2 1419 -1 8 {} O 0.0 {0.563912740064 0.384748985743 0.630135877909} O2 1420 -1 1 {} H 0.0 {0.573706173961 0.385057770226 0.633923633188} H1 1421 -1 8 {} O 0.0 {0.564584437227 0.356062307362 0.638975126744} O3 1422 -1 1 {} H 0.0 {0.558449246463 0.347826805983 0.636824998758} H2 1423 -1 8 {} O 0.0 {0.538763020834 0.368289891636 0.629667554094} O4 1424 -1 1 {} H 0.0 {0.537159076655 0.375938727764 0.622662243296} H3 1425 -1 8 {} O 0.0 {0.577414589665 0.362844049837 0.657017610438} O5 1426 -1 1 {} H 0.0 {0.585155616559 0.368796236029 0.653171550047} H4 1427 -1 8 {} O 0.0 {0.560489322017 0.364862445539 0.681741434249} O6 1428 -1 1 {} H 0.0 {0.568403472661 0.365098601436 0.688632585181} H5 1429 -1 8 {} O 0.0 {0.573695560454 0.389404369934 0.670543687558} O7 1430 -1 1 {} H 0.0 {0.580381939313 0.387911112569 0.678495727825} H6 1431 -1 14 {} Si 0.0 {0.608932954391 0.418024629554 0.698037704012} Si1 1432 -1 1 {} H 0.0 {0.640032920672 0.408349864713 0.68208179369} H2 1433 -1 8 {} O 0.0 {0.607558238587 0.400043261063 0.694498805763} O5 1434 -1 1 {} H 0.0 {0.600231212494 0.395817814217 0.700717042461} H4 1435 -1 8 {} O 0.0 {0.613049746178 0.427054018808 0.682531833172} O6 1436 -1 1 {} H 0.0 {0.604269709055 0.431003028748 0.678351474325} H5 1437 -1 8 {} O 0.0 {0.592936503432 0.42419406552 0.704712023334} O7 1438 -1 1 {} H 0.0 {0.58549440621 0.42322277658 0.697391418944} H6 1439 -1 14 {} Si 0.0 {0.253741144084 0.498340895045 0.476427471142} Si1 1440 -1 8 {} O 0.0 {0.270322634255 0.497749780048 0.48440125906} O1 1441 -1 14 {} Si 0.0 {0.283372977441 0.499130187095 0.471507706141} Si2 1442 -1 8 {} O 0.0 {0.275746178657 0.504481391243 0.455648390814} O2 1443 -1 1 {} H 0.0 {0.266164455293 0.508335195047 0.457526653983} H1 1444 -1 8 {} O 0.0 {0.295933575971 0.511521504325 0.476748499885} O3 1445 -1 1 {} H 0.0 {0.297595097005 0.510649062903 0.487078616728} H2 1446 -1 8 {} O 0.0 {0.29147549043 0.482776166578 0.469196915685} O4 1447 -1 1 {} H 0.0 {0.289960286725 0.479490762401 0.459341779065} H3 1448 -1 8 {} O 0.0 {0.255202692206 0.493160212316 0.458825006462} O7 1449 -1 1 {} H 0.0 {0.254131308653 0.482736115455 0.458157064745} H6 1450 -1 14 {} Si 0.0 {0.445673565187 0.572352051881 0.397699664468} Si1 1451 -1 8 {} O 0.0 {0.448780238529 0.585481794691 0.410214968799} O1 1452 -1 14 {} Si 0.0 {0.435915832669 0.598551985732 0.408818725286} Si2 1453 -1 8 {} O 0.0 {0.434773236131 0.607739044994 0.424758598744} O2 1454 -1 1 {} H 0.0 {0.425930086259 0.605031165451 0.429736361175} H1 1455 -1 8 {} O 0.0 {0.440502216668 0.610215676547 0.39530692445} O3 1456 -1 1 {} H 0.0 {0.443050345124 0.604775669629 0.386711865436} H2 1457 -1 8 {} O 0.0 {0.419655898279 0.590836666718 0.405023616288} O4 1458 -1 1 {} H 0.0 {0.419894988626 0.58069381974 0.407692110471} H3 1459 -1 8 {} O 0.0 {0.439000243864 0.579931546496 0.382331759972} O5 1460 -1 1 {} H 0.0 {0.442522764143 0.57459340273 0.37399817922} H4 1461 -1 8 {} O 0.0 {0.433503791517 0.560270615864 0.404366956337} O6 1462 -1 1 {} H 0.0 {0.435785246317 0.558200245719 0.414404257134} H5 1463 -1 8 {} O 0.0 {0.461455567753 0.563696995283 0.393893434347} O7 1464 -1 1 {} H 0.0 {0.459631777057 0.553414063237 0.392851992845} H6 1465 -1 14 {} Si 0.0 {0.495002524094 0.425736445221 0.652089833043} Si1 1466 -1 8 {} O 0.0 {0.487304564041 0.41752848254 0.66666735471} O1 1467 -1 14 {} Si 0.0 {0.469989885539 0.423324804822 0.668681641936} Si2 1468 -1 8 {} O 0.0 {0.463021444901 0.427766977749 0.652241006982} O2 1469 -1 1 {} H 0.0 {0.463502310731 0.438169439376 0.650947254053} H1 1470 -1 8 {} O 0.0 {0.459844872382 0.409928093894 0.676216241965} O3 1471 -1 1 {} H 0.0 {0.465705797559 0.404536061482 0.683058856019} H2 1472 -1 8 {} O 0.0 {0.469775765849 0.438074907526 0.679641159994} O4 1473 -1 1 {} H 0.0 {0.464026709239 0.445633371728 0.675202782548} H3 1474 -1 8 {} O 0.0 {0.512587513346 0.420473043598 0.650667637548} O5 1475 -1 1 {} H 0.0 {0.513195834253 0.411891400578 0.644641203442} H4 1476 -1 8 {} O 0.0 {0.494227425492 0.443973177178 0.654234884198} O6 1477 -1 1 {} H 0.0 {0.484408809237 0.447262392617 0.652560449793} H5 1478 -1 8 {} O 0.0 {0.485922250005 0.420978265199 0.636804555415} O7 1479 -1 1 {} H 0.0 {0.478954860854 0.428461308472 0.63441209446} H6 1480 -1 14 {} Si 0.0 {0.329987655818 0.412146896763 0.458444249715} Si1 1481 -1 8 {} O 0.0 {0.32384380052 0.399198512775 0.469985581148} O1 1482 -1 14 {} Si 0.0 {0.305521664881 0.398013982279 0.468809260338} Si2 1483 -1 8 {} O 0.0 {0.300977820855 0.383439526175 0.458639700922} O2 1484 -1 1 {} H 0.0 {0.300161493258 0.386315421366 0.448606250389} H1 1485 -1 8 {} O 0.0 {0.298448706853 0.396107009968 0.485659619906} O3 1486 -1 1 {} H 0.0 {0.300415427583 0.38641325384 0.48918310417} H2 1487 -1 8 {} O 0.0 {0.298813524381 0.413253575153 0.460983573044} O4 1488 -1 1 {} H 0.0 {0.303977065093 0.415147766918 0.452044390992} H3 1489 -1 8 {} O 0.0 {0.328497310538 0.406166129309 0.441099705884} O5 1490 -1 1 {} H 0.0 {0.323040489914 0.413136380344 0.435459290881} H4 1491 -1 8 {} O 0.0 {0.347630516096 0.415746065951 0.462192424472} O6 1492 -1 1 {} H 0.0 {0.349286244008 0.426088315867 0.461590495985} H5 1493 -1 8 {} O 0.0 {0.320035111998 0.427477604354 0.460522650709} O7 1494 -1 1 {} H 0.0 {0.326483904563 0.435695912516 0.4615993285} H6 1495 -1 8 {} O 0.0 {0.56625946531 0.460472556931 0.726253726577} O2 1496 -1 1 {} H 0.0 {0.56310841225 0.456744492052 0.716955935777} H1 1497 -1 8 {} O 0.0 {0.591787736873 0.448076826842 0.716445096771} O3 1498 -1 1 {} H 0.0 {0.592304518563 0.437674312954 0.715159096527} H2 1499 -1 14 {} Si 0.0 {0.370187508905 0.516515524846 0.623495825158} Si1 1500 -1 8 {} O 0.0 {0.368064710497 0.529472178928 0.636398799549} O1 1501 -1 14 {} Si 0.0 {0.368548541513 0.521553673319 0.652991681951} Si2 1502 -1 8 {} O 0.0 {0.351630471735 0.521545065914 0.660322343884} O2 1503 -1 1 {} H 0.0 {0.345256369762 0.527432710887 0.654402506951} H1 1504 -1 8 {} O 0.0 {0.374538984991 0.50423403157 0.651241689433} O3 1505 -1 1 {} H 0.0 {0.384051642857 0.504279378781 0.646758869092} H2 1506 -1 8 {} O 0.0 {0.379962961808 0.530859231048 0.66398576012} O4 1507 -1 1 {} H 0.0 {0.379067660513 0.54112077555 0.662038215341} H3 1508 -1 8 {} O 0.0 {0.386845097445 0.518119412405 0.615859608561} O5 1509 -1 1 {} H 0.0 {0.393705429497 0.512212317478 0.621181605777} H4 1510 -1 8 {} O 0.0 {0.35725890925 0.518494909859 0.610538842077} O6 1511 -1 1 {} H 0.0 {0.35611889212 0.52867998173 0.608269155223} H5 1512 -1 8 {} O 0.0 {0.368589169189 0.499898042487 0.631248174458} O7 1513 -1 1 {} H 0.0 {0.375479302375 0.493318348695 0.62684813093} H6 1514 -1 14 {} Si 0.0 {0.48427755044 0.482362270481 0.667613146033} Si1 1515 -1 8 {} O 0.0 {0.468210341927 0.479804846856 0.658908092122} O1 1516 -1 14 {} Si 0.0 {0.459701210421 0.495891754759 0.656154196778} Si2 1517 -1 8 {} O 0.0 {0.470847144124 0.509776392434 0.6607969964} O2 1518 -1 1 {} H 0.0 {0.474414318029 0.508293655618 0.67051876531} H1 1519 -1 8 {} O 0.0 {0.455175047275 0.497396475856 0.638388702837} O3 1520 -1 1 {} H 0.0 {0.463299600644 0.501355266212 0.633048708956} H2 1521 -1 8 {} O 0.0 {0.444414649432 0.496488581327 0.66640131928} O4 1522 -1 1 {} H 0.0 {0.443958837937 0.505648847898 0.671475270522} H3 1523 -1 8 {} O 0.0 {0.48377319178 0.497839992127 0.677559521376} O5 1524 -1 1 {} H 0.0 {0.492170603873 0.498181644316 0.683893096902} H4 1525 -1 8 {} O 0.0 {0.497852799756 0.483560199193 0.655274937027} O6 1526 -1 1 {} H 0.0 {0.497524571594 0.47521859673 0.648934974081} H5 1527 -1 8 {} O 0.0 {0.487394904447 0.468019165651 0.67874974531} O7 1528 -1 1 {} H 0.0 {0.484152724948 0.459189769746 0.674057011788} H6 1529 -1 14 {} Si 0.0 {0.376018209386 0.635852233188 0.463999666639} Si1 1530 -1 8 {} O 0.0 {0.384274463927 0.648134878828 0.453037318584} O1 1531 -1 14 {} Si 0.0 {0.373846062629 0.651175800344 0.438157897287} Si2 1532 -1 8 {} O 0.0 {0.356704511871 0.655343462502 0.443393584669} O2 1533 -1 1 {} H 0.0 {0.35018788488 0.647656866173 0.440439588499} H1 1534 -1 8 {} O 0.0 {0.380887236171 0.665189296136 0.428526641165} O3 1535 -1 1 {} H 0.0 {0.390914372981 0.663124630829 0.426184962088} H2 1536 -1 8 {} O 0.0 {0.373555445875 0.6360678262 0.427654683382} O4 1537 -1 1 {} H 0.0 {0.363623706344 0.633755815798 0.425143418934} H3 1538 -1 8 {} O 0.0 {0.387350725793 0.621649350398 0.466921664836} O5 1539 -1 1 {} H 0.0 {0.391122404153 0.622148046319 0.476711647725} H4 1540 -1 8 {} O 0.0 {0.360582079155 0.629843439466 0.456005562448} O6 1541 -1 1 {} H 0.0 {0.352412043434 0.631768439398 0.462313917054} H5 1542 -1 8 {} O 0.0 {0.371898504455 0.643787090073 0.480086390971} O7 1543 -1 1 {} H 0.0 {0.363876143799 0.650424619363 0.478746122969} H6 1544 -1 14 {} Si 0.0 {0.394573991613 0.291427237754 0.46284866552} Si1 1545 -1 8 {} O 0.0 {0.383910143924 0.297162321505 0.449018165097} O1 1546 -1 14 {} Si 0.0 {0.367547720819 0.288859313232 0.450211034096} Si2 1547 -1 8 {} O 0.0 {0.354293689993 0.301549887964 0.45153700629} O2 1548 -1 1 {} H 0.0 {0.353412601997 0.304638106201 0.461535108173} H1 1549 -1 8 {} O 0.0 {0.367246967784 0.27809120744 0.465127145532} O4 1550 -1 1 {} H 0.0 {0.36171433803 0.282789482985 0.472710857798} H3 1551 -1 8 {} O 0.0 {0.41193937444 0.296759977904 0.459878823726} O5 1552 -1 1 {} H 0.0 {0.41208853774 0.304209918715 0.452483756499} H4 1553 -1 8 {} O 0.0 {0.393886498552 0.273075861802 0.463878463376} O6 1554 -1 1 {} H 0.0 {0.38487465813 0.270177322305 0.468421898029} H5 1555 -1 8 {} O 0.0 {0.388511356192 0.298669575428 0.478636294857} O7 1556 -1 1 {} H 0.0 {0.378890395003 0.294981303868 0.480692719364} H6 1557 -1 8 {} O 0.0 {0.560289616142 0.285308091597 0.37261871934} O2 1558 -1 1 {} H 0.0 {0.554268595311 0.285472600803 0.38122189483} H1 1559 -1 8 {} O 0.0 {0.722543512972 0.559610417182 0.553487870529} O4 1560 -1 1 {} H 0.0 {0.715320695464 0.5520517472 0.552495592333} H3 1561 -1 14 {} Si 0.0 {0.651724638208 0.534084145428 0.43545065036} Si1 1562 -1 8 {} O 0.0 {0.645854403277 0.520005859816 0.425182189043} O1 1563 -1 14 {} Si 0.0 {0.639646145374 0.506593490822 0.436125278728} Si2 1564 -1 8 {} O 0.0 {0.653877679576 0.497052334963 0.442832316178} O2 1565 -1 1 {} H 0.0 {0.661475714035 0.503696988517 0.445724613355} H1 1566 -1 8 {} O 0.0 {0.630081779004 0.513914403816 0.450043444012} O3 1567 -1 1 {} H 0.0 {0.626232766312 0.52322899869 0.447106939543} H2 1568 -1 8 {} O 0.0 {0.628760052315 0.495366406327 0.426436982951} O4 1569 -1 1 {} H 0.0 {0.630714013105 0.496615819324 0.416192858565} H3 1570 -1 8 {} O 0.0 {0.653708627823 0.548986998404 0.424848511845} O5 1571 -1 1 {} H 0.0 {0.653145927109 0.557608001206 0.43080829647} H4 1572 -1 8 {} O 0.0 {0.667887297945 0.529781229116 0.443067998486} O6 1573 -1 1 {} H 0.0 {0.666458072788 0.527521071733 0.453222477323} H5 1574 -1 8 {} O 0.0 {0.639450579385 0.537557050012 0.448706582623} O7 1575 -1 1 {} H 0.0 {0.641544105606 0.531542604216 0.457058610895} H6 1576 -1 14 {} Si 0.0 {0.652273326875 0.447813752545 0.378052556565} Si1 1577 -1 8 {} O 0.0 {0.636736409924 0.454019637307 0.385755624975} O1 1578 -1 14 {} Si 0.0 {0.627711667788 0.464684688295 0.373749207954} Si2 1579 -1 8 {} O 0.0 {0.636459013771 0.480779371213 0.372039536169} O2 1580 -1 1 {} H 0.0 {0.630388524588 0.488470399275 0.375820801082} H1 1581 -1 8 {} O 0.0 {0.627010656495 0.456310187425 0.357382176422} O3 1582 -1 1 {} H 0.0 {0.628765123243 0.446038434205 0.35863654404} H2 1583 -1 8 {} O 0.0 {0.610602109424 0.467636636292 0.379859204469} O4 1584 -1 1 {} H 0.0 {0.609642582166 0.463753698868 0.389568003667} H3 1585 -1 8 {} O 0.0 {0.666249787317 0.450057363789 0.389812683898} O5 1586 -1 1 {} H 0.0 {0.664083243605 0.445090183311 0.398806186882} H4 1587 -1 8 {} O 0.0 {0.655676282802 0.45720328274 0.362609513685} O6 1588 -1 1 {} H 0.0 {0.652914646106 0.451393245154 0.354310708247} H5 1589 -1 8 {} O 0.0 {0.650428680481 0.429932085443 0.37409054581} O7 1590 -1 1 {} H 0.0 {0.651071249192 0.428583480793 0.363695642634} H6 1591 -1 1 {} H 0.0 {0.384504425501 0.634032968036 0.658711947127} H1 1592 -1 8 {} O 0.0 {0.363435501043 0.618593825924 0.644736724156} O4 1593 -1 1 {} H 0.0 {0.373064100899 0.618149752061 0.640570603107} H3 1594 -1 8 {} O 0.0 {0.32153684371 0.314941570788 0.493393292622} O3 1595 -1 1 {} H 0.0 {0.331749540518 0.313774763509 0.495489619596} H2 1596 -1 14 {} Si 0.0 {0.419728068856 0.313531168061 0.483899048535} Si1 1597 -1 8 {} O 0.0 {0.434279707307 0.321420591739 0.475872127023} O1 1598 -1 14 {} Si 0.0 {0.430983352843 0.339384249841 0.473831161962} Si2 1599 -1 8 {} O 0.0 {0.413080564088 0.342622093171 0.476623692933} O2 1600 -1 1 {} H 0.0 {0.407818617469 0.333539629699 0.476368348537} H1 1601 -1 8 {} O 0.0 {0.440907372329 0.348884233078 0.486070808853} O3 1602 -1 1 {} H 0.0 {0.450733840169 0.345192907484 0.486207744182} H2 1603 -1 8 {} O 0.0 {0.435603421972 0.344612653614 0.456794210264} O4 1604 -1 1 {} H 0.0 {0.431443263613 0.3379371321 0.449842656992} H3 1605 -1 8 {} O 0.0 {0.406835894891 0.310116270594 0.471238471561} O5 1606 -1 1 {} H 0.0 {0.400855398066 0.318636136954 0.469963428198} H4 1607 -1 8 {} O 0.0 {0.412939777962 0.324820324787 0.496708646342} O6 1608 -1 1 {} H 0.0 {0.415290241354 0.321070840955 0.506236447892} H5 1609 -1 8 {} O 0.0 {0.424820975036 0.297792240564 0.491815401443} O7 1610 -1 1 {} H 0.0 {0.422036096888 0.297901358385 0.50192261825} H6 1611 -1 8 {} O 0.0 {0.452319150251 0.596762344833 0.712597774409} O6 1612 -1 1 {} H 0.0 {0.456503595464 0.590473020922 0.705302767318} H5 1613 -1 1 {} H 0.0 {0.474600929726 0.580632413465 0.722446026987} H6 1614 -1 14 {} Si 0.0 {0.539598092292 0.65891467957 0.460230910354} Si1 1615 -1 8 {} O 0.0 {0.552420601242 0.668074341078 0.450703873347} O1 1616 -1 14 {} Si 0.0 {0.557539619653 0.683092239647 0.460035369937} Si2 1617 -1 8 {} O 0.0 {0.55882485136 0.67907089579 0.477940192757} O2 1618 -1 1 {} H 0.0 {0.549808419483 0.681543734477 0.482722439473} H1 1619 -1 8 {} O 0.0 {0.573878039232 0.688846981563 0.453841525641} O3 1620 -1 1 {} H 0.0 {0.574150244276 0.687949261032 0.443377931268} H2 1621 -1 8 {} O 0.0 {0.545066896268 0.696398328533 0.457630670443} O4 1622 -1 1 {} H 0.0 {0.539318802547 0.697413457659 0.466353895838} H3 1623 -1 8 {} O 0.0 {0.523012295458 0.662284691795 0.452972543373} O5 1624 -1 1 {} H 0.0 {0.521078711611 0.672587956571 0.453309813954} H4 1625 -1 8 {} O 0.0 {0.539831605682 0.664412416314 0.477783801923} O6 1626 -1 1 {} H 0.0 {0.540287857263 0.656009997517 0.484065685094} H5 1627 -1 8 {} O 0.0 {0.543110885661 0.640833113869 0.459371334351} O7 1628 -1 1 {} H 0.0 {0.543732397186 0.63690536921 0.469083141621} H6 1629 -1 14 {} Si 0.0 {0.388047996128 0.535353715453 0.711438508261} Si2 1630 -1 8 {} O 0.0 {0.390516159057 0.534211926866 0.693282712424} O3 1631 -1 1 {} H 0.0 {0.38614911791 0.542557774367 0.688646915282} H2 1632 -1 8 {} O 0.0 {0.404120455456 0.539057103633 0.719632668719} O4 1633 -1 14 {} Si 0.0 {0.687502487009 0.562583168521 0.532103489067} Si1 1634 -1 8 {} O 0.0 {0.700924080345 0.574639834295 0.528465159694} O1 1635 -1 14 {} Si 0.0 {0.700334537614 0.588300352242 0.540767541774} Si2 1636 -1 8 {} O 0.0 {0.68848253973 0.601179137921 0.535082541118} O2 1637 -1 1 {} H 0.0 {0.688551880558 0.601589949304 0.524589185712} H1 1638 -1 8 {} O 0.0 {0.694831462715 0.581650923253 0.557018116481} O3 1639 -1 1 {} H 0.0 {0.692117013936 0.571565882187 0.555914163508} H2 1640 -1 8 {} O 0.0 {0.717075045679 0.595730855491 0.542539350968} O4 1641 -1 8 {} O 0.0 {0.671795262056 0.571637123888 0.535210156108} O5 1642 -1 1 {} H 0.0 {0.666074225149 0.571808998033 0.526406362231} H4 1643 -1 8 {} O 0.0 {0.691953812977 0.552760495109 0.547000332469} O6 1644 -1 1 {} H 0.0 {0.689206118901 0.542746686284 0.545505171568} H5 1645 -1 8 {} O 0.0 {0.685317372746 0.551299594123 0.51777482418} O7 1646 -1 1 {} H 0.0 {0.69472676077 0.548264545273 0.514251093261} H6 1647 -1 14 {} Si 0.0 {0.287957262413 0.361375643539 0.508575832131} Si1 1648 -1 8 {} O 0.0 {0.307926336607 0.333928053549 0.501210489584} O3 1649 -1 1 {} H 0.0 {0.310656718145 0.32658012636 0.508129017415} H2 1650 -1 8 {} O 0.0 {0.289060615899 0.378429604041 0.501762948187} O6 1651 -1 1 {} H 0.0 {0.295318984535 0.384230821382 0.507857431717} H5 1652 -1 8 {} O 0.0 {0.304333927823 0.35655269486 0.515584974538} O7 1653 -1 1 {} H 0.0 {0.311907096393 0.36210891698 0.510886239008} H6 1654 -1 14 {} Si 0.0 {0.49460531445 0.522553318598 0.636201318719} Si1 1655 -1 8 {} O 0.0 {0.477950252299 0.518845487796 0.642842572818} O1 1656 -1 14 {} Si 0.0 {0.470138284273 0.534561443591 0.648016308151} Si2 1657 -1 8 {} O 0.0 {0.482786790329 0.547903812734 0.647975720247} O2 1658 -1 1 {} H 0.0 {0.48656051917 0.549101488673 0.638238493076} H1 1659 -1 8 {} O 0.0 {0.456702133725 0.538897466251 0.636213255781} O3 1660 -1 1 {} H 0.0 {0.460913241501 0.541197327211 0.626841129386} H2 1661 -1 8 {} O 0.0 {0.463255003201 0.532613854904 0.664980792036} O4 1662 -1 1 {} H 0.0 {0.470015972948 0.536582832463 0.671958690776} H3 1663 -1 8 {} O 0.0 {0.493309610202 0.526187310001 0.618266061605} O5 1664 -1 1 {} H 0.0 {0.485714695585 0.533265996668 0.616684447795} H4 1665 -1 8 {} O 0.0 {0.505640193079 0.508084337146 0.638833249468} O6 1666 -1 1 {} H 0.0 {0.510251104722 0.508876673407 0.648220944107} H5 1667 -1 8 {} O 0.0 {0.501459626093 0.537247514229 0.644879315392} O7 1668 -1 1 {} H 0.0 {0.51180671352 0.536081767813 0.646061701448} H6 1669 -1 14 {} Si 0.0 {0.302019650981 0.469891084999 0.340205489822} Si1 1670 -1 8 {} O 0.0 {0.320100281287 0.473230738775 0.339975462664} O5 1671 -1 1 {} H 0.0 {0.321915031721 0.482838480642 0.343795389571} H4 1672 -1 8 {} O 0.0 {0.294812459437 0.476233789649 0.355898516924} O7 1673 -1 1 {} H 0.0 {0.290520312473 0.46827072714 0.361234500444} H6 1674 -1 14 {} Si 0.0 {0.456235489495 0.638945769607 0.686265680403} Si1 1675 -1 8 {} O 0.0 {0.449537530017 0.638428465385 0.669106341366} O1 1676 -1 14 {} Si 0.0 {0.463203729321 0.63455589115 0.657499252531} Si2 1677 -1 8 {} O 0.0 {0.46883630022 0.650009452641 0.649216304099} O2 1678 -1 1 {} H 0.0 {0.462113137967 0.657782690484 0.651388311725} H1 1679 -1 8 {} O 0.0 {0.477191369032 0.627183631608 0.666912029392} O3 1680 -1 1 {} H 0.0 {0.484946599446 0.624728676826 0.660307098225} H2 1681 -1 8 {} O 0.0 {0.457317226665 0.622572479203 0.644835301605} O4 1682 -1 1 {} H 0.0 {0.447479558139 0.624990610079 0.642057904294} H3 1683 -1 8 {} O 0.0 {0.471495945388 0.628752026972 0.687094809427} O5 1684 -1 1 {} H 0.0 {0.4779965325 0.632807968739 0.694245407874} H4 1685 -1 14 {} Si 0.0 {0.561687325502 0.65050397315 0.333276733966} Si1 1686 -1 8 {} O 0.0 {0.548894496666 0.651797408614 0.320171327399} O1 1687 -1 14 {} Si 0.0 {0.554586237372 0.642235100249 0.305625246471} Si2 1688 -1 8 {} O 0.0 {0.55358525491 0.624259750609 0.30940417546} O2 1689 -1 1 {} H 0.0 {0.560843111842 0.621797594283 0.316588439076} H1 1690 -1 8 {} O 0.0 {0.572254098255 0.635799953027 0.329964079616} O6 1691 -1 1 {} H 0.0 {0.582354372065 0.638462973843 0.330948559202} H5 1692 -1 8 {} O 0.0 {0.55360164309 0.648646896219 0.349680780246} O7 1693 -1 1 {} H 0.0 {0.560036657599 0.64346008707 0.356162765727} H6 1694 -1 14 {} Si 0.0 {0.390303144618 0.330193139204 0.421067824762} Si1 1695 -1 8 {} O 0.0 {0.391063924561 0.341376774556 0.406491791802} O1 1696 -1 14 {} Si 0.0 {0.374148444672 0.347505406582 0.40269825264} Si2 1697 -1 8 {} O 0.0 {0.374589847467 0.357756776404 0.38742258994} O2 1698 -1 1 {} H 0.0 {0.382239138979 0.364898811576 0.38823245442} H1 1699 -1 8 {} O 0.0 {0.362904095794 0.333176228307 0.40014515855} O3 1700 -1 1 {} H 0.0 {0.368614455446 0.324523583752 0.398462955521} H2 1701 -1 8 {} O 0.0 {0.368026887274 0.357678485008 0.416758497203} O4 1702 -1 1 {} H 0.0 {0.37093259521 0.367669977243 0.41536392773} H3 1703 -1 8 {} O 0.0 {0.388915721457 0.340241091358 0.436415071226} O5 1704 -1 1 {} H 0.0 {0.380772154797 0.336828980193 0.442091838589} H4 1705 -1 8 {} O 0.0 {0.405576164584 0.319959573449 0.42179096669} O6 1706 -1 1 {} H 0.0 {0.407631756225 0.317468266681 0.431784484668} H5 1707 -1 8 {} O 0.0 {0.375619050461 0.319209492333 0.419574443461} O7 1708 -1 1 {} H 0.0 {0.378687146728 0.309187375048 0.420116567227} H6 1709 -1 14 {} Si 0.0 {0.486163482955 0.478515801459 0.483393818596} Si1 1710 -1 8 {} O 0.0 {0.495721134526 0.466531572347 0.473251199951} O1 1711 -1 14 {} Si 0.0 {0.495732926248 0.450042834445 0.481417191623} Si2 1712 -1 8 {} O 0.0 {0.481830814186 0.440034933883 0.474795479722} O2 1713 -1 1 {} H 0.0 {0.480908120391 0.441790367782 0.464473919991} H1 1714 -1 8 {} O 0.0 {0.51162228189 0.441526002481 0.477892714604} O3 1715 -1 1 {} H 0.0 {0.519283556054 0.445956699217 0.483551232948} H2 1716 -1 8 {} O 0.0 {0.493819313155 0.452039907626 0.499641073598} O4 1717 -1 1 {} H 0.0 {0.484151199696 0.455466066568 0.501802187987} H3 1718 -1 8 {} O 0.0 {0.49776179581 0.488204644882 0.493696130166} O5 1719 -1 1 {} H 0.0 {0.502977664327 0.494978504449 0.487634245907} H4 1720 -1 8 {} O 0.0 {0.474404025954 0.469508298804 0.494289019762} O6 1721 -1 1 {} H 0.0 {0.471609594193 0.475694991777 0.50229718039} H5 1722 -1 8 {} O 0.0 {0.476813374773 0.489844613599 0.472378830846} O7 1723 -1 1 {} H 0.0 {0.466564208451 0.489077193977 0.474501617956} H6 1724 -1 1 {} H 0.0 {0.393506855291 0.263386018655 0.513293568856} H2 1725 -1 8 {} O 0.0 {0.382429801058 0.274189887044 0.538201838994} O4 1726 -1 1 {} H 0.0 {0.386569702424 0.271372223221 0.547428439373} H3 1727 -1 8 {} O 0.0 {0.354464817014 0.289244891707 0.535454522246} O5 1728 -1 1 {} H 0.0 {0.351457562512 0.291298204745 0.525602052258} H4 1729 -1 14 {} Si 0.0 {0.44496298896 0.560015707921 0.51456276854} Si1 1730 -1 8 {} O 0.0 {0.433887431619 0.574687573877 0.514854919038} O1 1731 -1 14 {} Si 0.0 {0.44115677214 0.58758058088 0.525697559751} Si2 1732 -1 8 {} O 0.0 {0.440132128062 0.582101648618 0.543222076412} O2 1733 -1 1 {} H 0.0 {0.433280191872 0.574180973177 0.543999778463} H1 1734 -1 8 {} O 0.0 {0.458778034466 0.590241807194 0.521105425543} O3 1735 -1 1 {} H 0.0 {0.46041455546 0.600443370242 0.519316211648} H2 1736 -1 8 {} O 0.0 {0.431794572624 0.603247025123 0.523588180532} O4 1737 -1 1 {} H 0.0 {0.422945618979 0.601332739961 0.518270572985} H3 1738 -1 8 {} O 0.0 {0.437487865842 0.546545070678 0.524572751101} O5 1739 -1 1 {} H 0.0 {0.440623450305 0.537284162216 0.520807629289} H4 1740 -1 8 {} O 0.0 {0.461338883133 0.564537301774 0.521613927681} O6 1741 -1 1 {} H 0.0 {0.467705489148 0.567702714806 0.513889783978} H5 1742 -1 8 {} O 0.0 {0.447117234717 0.554294547722 0.497197326703} O7 1743 -1 1 {} H 0.0 {0.455916316847 0.548619371519 0.496457767966} H6 1744 -1 8 {} O 0.0 {0.716341980316 0.405247940855 0.44215068482} O3 1745 -1 1 {} H 0.0 {0.718321023721 0.414965681469 0.445592482964} H2 1746 -1 8 {} O 0.0 {0.716122238331 0.416249662713 0.414191843936} O4 1747 -1 1 {} H 0.0 {0.713428280061 0.411950878233 0.404996624499} H3 1748 -1 14 {} Si 0.0 {0.442165654191 0.345367075458 0.676485870635} Si1 1749 -1 8 {} O 0.0 {0.456744295815 0.349205061437 0.686959936022} O1 1750 -1 14 {} Si 0.0 {0.471533699819 0.341474279519 0.679361589124} Si2 1751 -1 8 {} O 0.0 {0.470626536508 0.343462407589 0.661096354469} O2 1752 -1 1 {} H 0.0 {0.460602680647 0.342681976812 0.658004335403} H1 1753 -1 8 {} O 0.0 {0.486762957 0.349601277811 0.685723146065} O3 1754 -1 1 {} H 0.0 {0.485857289278 0.360004907727 0.684691209351} H2 1755 -1 8 {} O 0.0 {0.443490381308 0.35455640677 0.660597147363} O5 1756 -1 1 {} H 0.0 {0.436851099051 0.362673890411 0.660691830906} H4 1757 -1 8 {} O 0.0 {0.426780054727 0.35032233543 0.685241581433} O6 1758 -1 8 {} O 0.0 {0.441736658585 0.32729589194 0.673070709582} O7 1759 -1 14 {} Si 0.0 {0.483911277568 0.477430640419 0.546553040569} Si1 1760 -1 8 {} O 0.0 {0.483421869918 0.46978146845 0.56319996763} O1 1761 -1 14 {} Si 0.0 {0.497838815168 0.458515371856 0.564931428821} Si2 1762 -1 8 {} O 0.0 {0.4919517322 0.44113638291 0.56615690408} O2 1763 -1 1 {} H 0.0 {0.483778523333 0.440676929132 0.572714322802} H1 1764 -1 8 {} O 0.0 {0.508753166876 0.46023747163 0.550208871072} O3 1765 -1 1 {} H 0.0 {0.505921694982 0.468723981635 0.544739421006} H2 1766 -1 8 {} O 0.0 {0.507267126226 0.462916107599 0.580083743139} O4 1767 -1 1 {} H 0.0 {0.50124080196 0.461305984752 0.588518536321} H3 1768 -1 8 {} O 0.0 {0.491880022239 0.494051941619 0.547672993808} O5 1769 -1 1 {} H 0.0 {0.500769007112 0.494107300481 0.542066168412} H4 1770 -1 8 {} O 0.0 {0.466783817882 0.479226621921 0.540082612343} O6 1771 -1 1 {} H 0.0 {0.466407984374 0.475732508921 0.530187206077} H5 1772 -1 8 {} O 0.0 {0.493600869387 0.466542026651 0.535292982213} O7 1773 -1 1 {} H 0.0 {0.487022347686 0.460538726146 0.529749260176} H6 1774 -1 14 {} Si 0.0 {0.660686902187 0.542706479435 0.478276002699} Si1 1775 -1 8 {} O 0.0 {0.658065705239 0.559152106376 0.486231576077} O1 1776 -1 14 {} Si 0.0 {0.673917853349 0.565532413856 0.493141997349} Si2 1777 -1 8 {} O 0.0 {0.683734590869 0.551633228464 0.500047086686} O2 1778 -1 1 {} H 0.0 {0.677272215013 0.544768452376 0.504694967364} H1 1779 -1 8 {} O 0.0 {0.683506763199 0.573860509877 0.479839514328} O3 1780 -1 1 {} H 0.0 {0.68013702816 0.583753955503 0.478783751308} H2 1781 -1 8 {} O 0.0 {0.670281012158 0.577622951886 0.506520445104} O4 1782 -1 1 {} H 0.0 {0.660711583637 0.581674291913 0.505053702091} H3 1783 -1 8 {} O 0.0 {0.677917349558 0.536938136077 0.48116375485} O5 1784 -1 1 {} H 0.0 {0.681077588535 0.539978093996 0.490626549538} H4 1785 -1 8 {} O 0.0 {0.657768075307 0.544147322458 0.460184654892} O6 1786 -1 1 {} H 0.0 {0.661823803282 0.553184976654 0.456718740965} H5 1787 -1 8 {} O 0.0 {0.648839622393 0.530566065395 0.485420327543} O7 1788 -1 1 {} H 0.0 {0.640965966928 0.53572097818 0.490104688567} H6 1789 -1 14 {} Si 0.0 {0.405352391436 0.357602092541 0.396723823361} Si1 1790 -1 8 {} O 0.0 {0.421266071892 0.36569869705 0.401301281692} O1 1791 -1 14 {} Si 0.0 {0.435402949261 0.354627639128 0.39711507413} Si2 1792 -1 8 {} O 0.0 {0.436958339657 0.353224976385 0.378824174599} O2 1793 -1 1 {} H 0.0 {0.427440480504 0.351973091456 0.374592912309} H1 1794 -1 8 {} O 0.0 {0.450926264159 0.361691466924 0.404024191229} O3 1795 -1 1 {} H 0.0 {0.44907674658 0.365404865999 0.413670844736} H2 1796 -1 8 {} O 0.0 {0.432540640316 0.337945924485 0.404342734565} O4 1797 -1 1 {} H 0.0 {0.426380120736 0.332371882994 0.397932304945} H3 1798 -1 8 {} O 0.0 {0.400608525521 0.362599320805 0.379661683246} O5 1799 -1 1 {} H 0.0 {0.405399821471 0.356346088246 0.372730824664} H4 1800 -1 8 {} O 0.0 {0.392203350881 0.362867039109 0.408490562196} O6 1801 -1 1 {} H 0.0 {0.393219020059 0.357549990763 0.417483268638} H5 1802 -1 8 {} O 0.0 {0.407283666907 0.33930733878 0.397444354237} O7 1803 -1 1 {} H 0.0 {0.410911223404 0.336549723227 0.406901947567} H6 1804 -1 8 {} O 0.0 {0.458972339817 0.303334753825 0.645051205253} O4 1805 -1 1 {} H 0.0 {0.466300957767 0.308405425444 0.650595791214} H3 1806 -1 14 {} Si 0.0 {0.283113481001 0.538159011698 0.484620465445} Si1 1807 -1 8 {} O 0.0 {0.290466613887 0.551525886718 0.494961175072} O1 1808 -1 14 {} Si 0.0 {0.278626161339 0.556221002196 0.508223977546} Si2 1809 -1 8 {} O 0.0 {0.27843568306 0.54318448253 0.52119752407} O2 1810 -1 1 {} H 0.0 {0.277382562542 0.53376994614 0.516663449159} H1 1811 -1 8 {} O 0.0 {0.283655241363 0.572278242646 0.515659109749} O3 1812 -1 1 {} H 0.0 {0.280752293966 0.580126651103 0.509311490717} H2 1813 -1 8 {} O 0.0 {0.261893235133 0.557854684323 0.501021762326} O4 1814 -1 1 {} H 0.0 {0.259853562508 0.549480057515 0.495071841675} H3 1815 -1 8 {} O 0.0 {0.265143919226 0.541345084728 0.482198989426} O5 1816 -1 1 {} H 0.0 {0.263742138781 0.551304140537 0.479184032182} H4 1817 -1 8 {} O 0.0 {0.285340787085 0.521959689158 0.493053082735} O6 1818 -1 1 {} H 0.0 {0.277120340716 0.515771105768 0.49096175821} H5 1819 -1 8 {} O 0.0 {0.291479122607 0.537749613784 0.468251174992} O7 1820 -1 1 {} H 0.0 {0.288182823582 0.529370430445 0.46285359977} H6 1821 -1 14 {} Si 0.0 {0.518084649829 0.563800887868 0.375735447348} Si1 1822 -1 8 {} O 0.0 {0.519413330547 0.549170836938 0.364663473655} O1 1823 -1 14 {} Si 0.0 {0.518707616466 0.533811160297 0.374779514575} Si2 1824 -1 8 {} O 0.0 {0.527337107359 0.52020694655 0.365887964247} O2 1825 -1 1 {} H 0.0 {0.520557488693 0.5153652644 0.359502725475} H1 1826 -1 8 {} O 0.0 {0.526987165989 0.536754063675 0.390962298571} O3 1827 -1 1 {} H 0.0 {0.519763368113 0.539035582582 0.398227840563} H2 1828 -1 8 {} O 0.0 {0.501134425356 0.529122212336 0.377615167042} O4 1829 -1 1 {} H 0.0 {0.500704916403 0.519410253594 0.381586308661} H3 1830 -1 8 {} O 0.0 {0.534812138244 0.570837623482 0.37866149298} O5 1831 -1 1 {} H 0.0 {0.533916883967 0.579865235224 0.38393695537} H4 1832 -1 8 {} O 0.0 {0.510720326463 0.558648626824 0.391761604163} O6 1833 -1 1 {} H 0.0 {0.509561776505 0.548231105457 0.391832350771} H5 1834 -1 8 {} O 0.0 {0.507357793322 0.576516192256 0.367889861507} O7 1835 -1 1 {} H 0.0 {0.506671110537 0.584874846224 0.374208540779} H6 1836 -1 8 {} O 0.0 {0.70921052797 0.438252775753 0.599755110781} O1 1837 -1 14 {} Si 0.0 {0.702504896525 0.426611757653 0.612293022624} Si2 1838 -1 8 {} O 0.0 {0.695576043316 0.436149086468 0.626359852181} O2 1839 -1 1 {} H 0.0 {0.697703605776 0.446331486028 0.625018839479} H1 1840 -1 8 {} O 0.0 {0.68927373832 0.416297008114 0.604756921862} O3 1841 -1 1 {} H 0.0 {0.691651278661 0.406141833548 0.605986619997} H2 1842 -1 14 {} Si 0.0 {0.646730140916 0.395096125205 0.494662981153} Si1 1843 -1 8 {} O 0.0 {0.654505943867 0.394971459334 0.511278052766} O1 1844 -1 14 {} Si 0.0 {0.672433100716 0.398539850722 0.50953806134} Si2 1845 -1 8 {} O 0.0 {0.679046280031 0.389659571392 0.494807877345} O2 1846 -1 1 {} H 0.0 {0.676241642819 0.379555485701 0.495275884154} H1 1847 -1 8 {} O 0.0 {0.674888930504 0.41671136253 0.507564480048} O3 1848 -1 1 {} H 0.0 {0.677041679223 0.418972103869 0.49754227019} H2 1849 -1 8 {} O 0.0 {0.681253128707 0.392789509127 0.524580018175} O4 1850 -1 1 {} H 0.0 {0.687587119402 0.384844864452 0.522041660103} H3 1851 -1 8 {} O 0.0 {0.659772881625 0.397143008105 0.481891572099} O5 1852 -1 1 {} H 0.0 {0.660463466321 0.407267957473 0.479208004646} H4 1853 -1 8 {} O 0.0 {0.634844184729 0.409061316171 0.493559860373} O6 1854 -1 1 {} H 0.0 {0.625175562457 0.40557228844 0.49566042812} H5 1855 -1 8 {} O 0.0 {0.637846275811 0.37922756168 0.491923305853} O7 1856 -1 1 {} H 0.0 {0.630168959035 0.378266132348 0.499023202788} H6 1857 -1 14 {} Si 0.0 {0.463945431979 0.265728573915 0.427127288983} Si1 1858 -1 8 {} O 0.0 {0.478983886283 0.271290908862 0.436138384551} O1 1859 -1 14 {} Si 0.0 {0.478489777292 0.28957645478 0.43797042811} Si2 1860 -1 8 {} O 0.0 {0.48980523344 0.294741534276 0.451540675556} O2 1861 -1 1 {} H 0.0 {0.488925627371 0.288028514783 0.459561587216} H1 1862 -1 8 {} O 0.0 {0.483821877662 0.297414518184 0.422215643631} O3 1863 -1 1 {} H 0.0 {0.480101644818 0.291840669316 0.414128147649} H2 1864 -1 8 {} O 0.0 {0.46131947722 0.294865078346 0.441941532752} O4 1865 -1 1 {} H 0.0 {0.461615962987 0.30341251666 0.448025658848} H3 1866 -1 8 {} O 0.0 {0.462836999133 0.274593683738 0.411062662632} O5 1867 -1 1 {} H 0.0 {0.46986639125 0.270581672015 0.404384525978} H4 1868 -1 8 {} O 0.0 {0.448996584874 0.269476914061 0.437207808262} O6 1869 -1 1 {} H 0.0 {0.447605223507 0.261927135288 0.444342559905} H5 1870 -1 1 {} H 0.0 {0.641144684174 0.292625235478 0.450912112221} H6 1871 -1 14 {} Si 0.0 {0.643062667221 0.454951114773 0.322759798211} Si1 1872 -1 8 {} O 0.0 {0.658025986811 0.465496472403 0.324116672589} O1 1873 -1 8 {} O 0.0 {0.641123630142 0.449326571632 0.305351643555} O5 1874 -1 1 {} H 0.0 {0.638134206787 0.439269995383 0.305247804971} H4 1875 -1 8 {} O 0.0 {0.628283585275 0.464675598238 0.327749866272} O6 1876 -1 1 {} H 0.0 {0.625005509783 0.461438411923 0.337174855986} H5 1877 -1 8 {} O 0.0 {0.644822496412 0.440323066081 0.33378785692} O7 1878 -1 1 {} H 0.0 {0.637729710788 0.44090122394 0.341506515176} H6 1879 -1 1 {} H 0.0 {0.680006685625 0.536316634475 0.656133452928} H6 1880 -1 14 {} Si 0.0 {0.368260211039 0.640714108641 0.553781647294} Si1 1881 -1 8 {} O 0.0 {0.362881399677 0.657955043338 0.557397511816} O1 1882 -1 14 {} Si 0.0 {0.367874488591 0.662753538651 0.574574442543} Si2 1883 -1 8 {} O 0.0 {0.375364660033 0.648326640822 0.583079267898} O2 1884 -1 1 {} H 0.0 {0.371854454655 0.647938001602 0.592964469459} H1 1885 -1 8 {} O 0.0 {0.3801967844 0.676465111745 0.573803034954} O3 1886 -1 1 {} H 0.0 {0.375792181768 0.684916919871 0.569396448576} H2 1887 -1 8 {} O 0.0 {0.353084308366 0.668351920097 0.583988117766} O4 1888 -1 1 {} H 0.0 {0.348143608468 0.660015650094 0.587980687842} H3 1889 -1 8 {} O 0.0 {0.383410933465 0.636802753525 0.563444436358} O5 1890 -1 1 {} H 0.0 {0.381668701813 0.628309832459 0.569358739684} H4 1891 -1 8 {} O 0.0 {0.371861251542 0.639071681043 0.535785744598} O6 1892 -1 1 {} H 0.0 {0.366483470829 0.630936723776 0.531872998678} H5 1893 -1 8 {} O 0.0 {0.354837647282 0.629026729589 0.558394276047} O7 1894 -1 1 {} H 0.0 {0.351954433984 0.623515900084 0.549933190446} H6 1895 -1 14 {} Si 0.0 {0.650728659216 0.307365454529 0.48112008988} Si1 1896 -1 8 {} O 0.0 {0.638373853872 0.306720401041 0.494742822687} O1 1897 -1 14 {} Si 0.0 {0.629293611743 0.32270726755 0.49558473522} Si2 1898 -1 8 {} O 0.0 {0.639828800139 0.335321509701 0.503865558997} O2 1899 -1 1 {} H 0.0 {0.649923371124 0.332579560344 0.502957114273} H1 1900 -1 8 {} O 0.0 {0.625127187 0.32832451872 0.478561836838} O3 1901 -1 1 {} H 0.0 {0.616078312621 0.323929015046 0.475555664612} H2 1902 -1 8 {} O 0.0 {0.613813560966 0.320438260033 0.505207171123} O4 1903 -1 1 {} H 0.0 {0.61598982902 0.315446797965 0.514171904539} H3 1904 -1 8 {} O 0.0 {0.646953271349 0.29422693752 0.468806097536} O5 1905 -1 1 {} H 0.0 {0.636576793579 0.29265862569 0.468463064831} H4 1906 -1 1 {} H 0.0 {0.667963000551 0.308292727529 0.497827832695} H5 1907 -1 8 {} O 0.0 {0.650028373283 0.323819951935 0.472924489651} O7 1908 -1 1 {} H 0.0 {0.650568132287 0.322563970754 0.462512555442} H6 1909 -1 14 {} Si 0.0 {0.576423745219 0.628214676078 0.493917889783} Si1 1910 -1 8 {} O 0.0 {0.573744361219 0.646172985667 0.490651115845} O1 1911 -1 14 {} Si 0.0 {0.574828387941 0.649437482705 0.472543873567} Si2 1912 -1 8 {} O 0.0 {0.557885075421 0.651330185708 0.465708260899} O2 1913 -1 1 {} H 0.0 {0.550885397937 0.650085729052 0.4733938139} H1 1914 -1 8 {} O 0.0 {0.584331153013 0.664907029717 0.469603136017} O3 1915 -1 1 {} H 0.0 {0.590533314502 0.666806410245 0.477837051974} H2 1916 -1 8 {} O 0.0 {0.583310992906 0.635366046062 0.464246835763} O4 1917 -1 1 {} H 0.0 {0.593523929733 0.635511036922 0.466696280636} H3 1918 -1 8 {} O 0.0 {0.592573395674 0.623066321536 0.486796186338} O5 1919 -1 1 {} H 0.0 {0.600324104528 0.628094081402 0.491769845443} H4 1920 -1 8 {} O 0.0 {0.562896100746 0.618380923397 0.486153730201} O6 1921 -1 1 {} H 0.0 {0.556115509566 0.615307996572 0.49356013151} H5 1922 -1 8 {} O 0.0 {0.576482609224 0.625243032972 0.512065921916} O7 1923 -1 1 {} H 0.0 {0.57035268588 0.61700720883 0.51427061851} H6 1924 -1 14 {} Si 0.0 {0.631304174235 0.299880547711 0.541989149532} Si2 1925 -1 8 {} O 0.0 {0.626114217034 0.302756135443 0.559436837877} O2 1926 -1 1 {} H 0.0 {0.621092719129 0.294262617616 0.56304655362} H1 1927 -1 8 {} O 0.0 {0.637722835602 0.315549887317 0.534636473831} O3 1928 -1 1 {} H 0.0 {0.639533286501 0.314119043524 0.52439807801} H2 1929 -1 8 {} O 0.0 {0.616983343304 0.293914837913 0.532173548189} O4 1930 -1 1 {} H 0.0 {0.619108325007 0.28435461727 0.528384984034} H3 1931 -1 8 {} O 0.0 {0.630623446894 0.285414380907 0.514931625524} O6 1932 -1 1 {} H 0.0 {0.625221687587 0.276649280754 0.51295013309} H5 1933 -1 1 {} H 0.0 {0.745133806038 0.502946324927 0.484698206262} H4 1934 -1 14 {} Si 0.0 {0.549717818209 0.713729583683 0.494613625024} Si1 1935 -1 8 {} O 0.0 {0.560369875088 0.724739671627 0.504815645671} O1 1936 -1 14 {} Si 0.0 {0.572413329287 0.714572159186 0.514311012862} Si2 1937 -1 8 {} O 0.0 {0.570111760496 0.71755989758 0.53231472826} O2 1938 -1 8 {} O 0.0 {0.569649411819 0.696753167726 0.510646764341} O3 1939 -1 1 {} H 0.0 {0.576392813218 0.693630285318 0.503230934593} H2 1940 -1 8 {} O 0.0 {0.58953585371 0.719248667561 0.5094712881} O4 1941 -1 8 {} O 0.0 {0.537079014195 0.723834621974 0.485867020356} O5 1942 -1 1 {} H 0.0 {0.540982951338 0.727125522299 0.476692464681} H4 1943 -1 8 {} O 0.0 {0.541326980295 0.701493152213 0.505498241596} O6 1944 -1 1 {} H 0.0 {0.54701181506 0.692675445911 0.50587222602} H5 1945 -1 8 {} O 0.0 {0.560089435981 0.704865442281 0.482258094431} O7 1946 -1 1 {} H 0.0 {0.567550305174 0.699409770894 0.487232731756} H6 1947 -1 14 {} Si 0.0 {0.323709455235 0.621809194208 0.412310376527} Si1 1948 -1 8 {} O 0.0 {0.328550989478 0.614523755374 0.396084097029} O1 1949 -1 14 {} Si 0.0 {0.321092231941 0.597759324619 0.394271660994} Si2 1950 -1 8 {} O 0.0 {0.304109303909 0.5977756864 0.401255189105} O2 1951 -1 8 {} O 0.0 {0.320292261955 0.593297888022 0.376443332776} O3 1952 -1 1 {} H 0.0 {0.318666092215 0.601968267258 0.370747041328} H2 1953 -1 8 {} O 0.0 {0.331401085829 0.5854269292 0.403240851927} O4 1954 -1 1 {} H 0.0 {0.328597181257 0.575739384494 0.400306624184} H3 1955 -1 8 {} O 0.0 {0.305831707896 0.618663942545 0.415415778954} O5 1956 -1 1 {} H 0.0 {0.303660821653 0.608586861261 0.413469635515} H4 1957 -1 8 {} O 0.0 {0.326715131542 0.639951363565 0.412016010954} O6 1958 -1 1 {} H 0.0 {0.319101262184 0.644830189085 0.417355562699} H5 1959 -1 8 {} O 0.0 {0.333746572072 0.614176416394 0.425735576296} O7 1960 -1 1 {} H 0.0 {0.335869902706 0.621407908075 0.433056092007} H6 1961 -1 8 {} O 0.0 {0.303268481971 0.519352217227 0.344835073694} O1 1962 -1 8 {} O 0.0 {0.290891493109 0.535599849274 0.366747345817} O3 1963 -1 1 {} H 0.0 {0.285051473375 0.527300464686 0.369449773097} H2 1964 -1 1 {} H 0.0 {0.298841640913 0.490658216161 0.34894537141} H6 1965 -1 8 {} O 0.0 {0.337041834176 0.391336680312 0.337437065834} O1 1966 -1 14 {} Si 0.0 {0.337661362779 0.374807570487 0.345340367437} Si2 1967 -1 8 {} O 0.0 {0.355176161206 0.369565999615 0.347191885219} O2 1968 -1 1 {} H 0.0 {0.361480283336 0.377376664164 0.344130821446} H1 1969 -1 8 {} O 0.0 {0.329701387739 0.375704379467 0.3618930496} O3 1970 -1 1 {} H 0.0 {0.325986278138 0.385413159467 0.36345044538} H2 1971 -1 8 {} O 0.0 {0.318363083107 0.406030523648 0.355820049779} O7 1972 -1 1 {} H 0.0 {0.32025497653 0.416312078303 0.355079506317} H6 1973 -1 8 {} O 0.0 {0.495640208106 0.306104865409 0.337753816631} O1 1974 -1 14 {} Si 0.0 {0.485288061065 0.307199065544 0.35290375088} Si2 1975 -1 8 {} O 0.0 {0.496055268114 0.306299661302 0.367789394848} O2 1976 -1 1 {} H 0.0 {0.503977591249 0.3131107566 0.366774876199} H1 1977 -1 8 {} O 0.0 {0.476108180251 0.323146779835 0.352917255037} O3 1978 -1 1 {} H 0.0 {0.480731157956 0.329834852803 0.346268972862} H2 1979 -1 8 {} O 0.0 {0.473322847966 0.293220529808 0.353137818875} O4 1980 -1 1 {} H 0.0 {0.478518302557 0.284166398143 0.35196457381} H3 1981 -1 14 {} Si 0.0 {0.318277696807 0.341238421283 0.456032771854} Si1 1982 -1 8 {} O 0.0 {0.316163666379 0.339612768196 0.43780362091} O1 1983 -1 14 {} Si 0.0 {0.310150978237 0.355601263671 0.430921152406} Si2 1984 -1 8 {} O 0.0 {0.297536232226 0.362754776505 0.442223300455} O2 1985 -1 8 {} O 0.0 {0.324276587342 0.367293195576 0.429286011411} O3 1986 -1 1 {} H 0.0 {0.326662911287 0.368484596903 0.419128770759} H2 1987 -1 8 {} O 0.0 {0.334626377405 0.348824960789 0.459616200261} O5 1988 -1 1 {} H 0.0 {0.33320358334 0.358117643228 0.464302076538} H4 1989 -1 8 {} O 0.0 {0.317340883806 0.324664551255 0.463916765572} O6 1990 -1 1 {} H 0.0 {0.316649947351 0.325786794954 0.474321315952} H5 1991 -1 8 {} O 0.0 {0.304962670292 0.351896583051 0.462838357724} O7 1992 -1 1 {} H 0.0 {0.295652770203 0.347316362753 0.46122618237} H6 1993 -1 14 {} Si 0.0 {0.623210167079 0.569009195537 0.450858042449} Si1 1994 -1 8 {} O 0.0 {0.619229164145 0.569535317325 0.432896349678} O1 1995 -1 14 {} Si 0.0 {0.624564782853 0.58566035164 0.42577650482} Si2 1996 -1 8 {} O 0.0 {0.619400796047 0.586493217958 0.408142159873} O2 1997 -1 1 {} H 0.0 {0.613624681355 0.578037408831 0.40580173481} H1 1998 -1 8 {} O 0.0 {0.616716921921 0.599448424564 0.435101323267} O3 1999 -1 1 {} H 0.0 {0.608372993324 0.595823155266 0.440327140709} H2 2000 -1 8 {} O 0.0 {0.642879807846 0.58715740918 0.426889191999} O4 2001 -1 1 {} H 0.0 {0.646961573782 0.577960101177 0.429873343899} H3 2002 -1 8 {} O 0.0 {0.613255151205 0.555805314869 0.458917552093} O5 2003 -1 1 {} H 0.0 {0.619567253618 0.547901054536 0.461725494812} H4 2004 -1 8 {} O 0.0 {0.619214608296 0.585243026974 0.458546274161} O6 2005 -1 1 {} H 0.0 {0.624819326033 0.592788127447 0.453879106961} H5 2006 -1 8 {} O 0.0 {0.641111488471 0.565378632712 0.453079684006} O7 2007 -1 1 {} H 0.0 {0.646204191935 0.574246325151 0.455437613194} H6 2008 -1 14 {} Si 0.0 {0.338653289365 0.376367712104 0.604850060765} Si1 2009 -1 8 {} O 0.0 {0.342574091031 0.394347978248 0.603882719179} O1 2010 -1 14 {} Si 0.0 {0.357723813504 0.396902272793 0.593718229788} Si2 2011 -1 8 {} O 0.0 {0.363632804962 0.414193898571 0.595734920362} O2 2012 -1 1 {} H 0.0 {0.365128013637 0.418484423747 0.586256386784} H1 2013 -1 8 {} O 0.0 {0.370881897135 0.385245581556 0.599195753371} O3 2014 -1 1 {} H 0.0 {0.367294699186 0.379421209888 0.607162678832} H2 2015 -1 8 {} O 0.0 {0.353815805749 0.393916440813 0.576017217295} O4 2016 -1 1 {} H 0.0 {0.34342551672 0.393091040005 0.574825484475} H3 2017 -1 8 {} O 0.0 {0.336811865826 0.371455265892 0.622486555422} O5 2018 -1 1 {} H 0.0 {0.327703476939 0.375143139854 0.626199537134} H4 2019 -1 8 {} O 0.0 {0.352250309263 0.366647526231 0.597156504521} O6 2020 -1 1 {} H 0.0 {0.348481248361 0.361259902696 0.588963800256} H5 2021 -1 8 {} O 0.0 {0.322918184614 0.373023131774 0.59591301756} O7 2022 -1 1 {} H 0.0 {0.323349115004 0.377336920906 0.586354746119} H6 2023 -1 14 {} Si 0.0 {0.373232268338 0.532547553262 0.308166006445} Si1 2024 -1 8 {} O 0.0 {0.375188230842 0.519251640519 0.320892559172} O1 2025 -1 14 {} Si 0.0 {0.362959494408 0.521460550562 0.334662349256} Si2 2026 -1 8 {} O 0.0 {0.363806261609 0.538689468282 0.341182360676} O2 2027 -1 1 {} H 0.0 {0.361376933811 0.538680884044 0.351399002909} H1 2028 -1 8 {} O 0.0 {0.345954974873 0.51813209945 0.328493191723} O3 2029 -1 1 {} H 0.0 {0.346409694104 0.51150017606 0.320397531086} H2 2030 -1 8 {} O 0.0 {0.366963630269 0.509650283139 0.348209014061} O4 2031 -1 1 {} H 0.0 {0.376206736454 0.505051937431 0.346224043555} H3 2032 -1 8 {} O 0.0 {0.385995747493 0.530390305533 0.295087223075} O5 2033 -1 1 {} H 0.0 {0.388324170336 0.539738462293 0.290910467886} H4 2034 -1 8 {} O 0.0 {0.37532211475 0.549044845501 0.316048155522} O6 2035 -1 1 {} H 0.0 {0.371130299473 0.556408862964 0.309877962236} H5 2036 -1 8 {} O 0.0 {0.356484275432 0.531461698809 0.300590942805} O7 2037 -1 14 {} Si 0.0 {0.675084492864 0.521701062413 0.322118491254} Si1 2038 -1 8 {} O 0.0 {0.656860482843 0.524574811201 0.321908482042} O1 2039 -1 14 {} Si 0.0 {0.648145946505 0.509729129865 0.328526765347} Si2 2040 -1 8 {} O 0.0 {0.635419938833 0.504160239952 0.316370446876} O2 2041 -1 1 {} H 0.0 {0.634968596694 0.510966700458 0.308406246485} H1 2042 -1 8 {} O 0.0 {0.660328298939 0.4962336312 0.331334851942} O3 2043 -1 1 {} H 0.0 {0.666967252507 0.495775246803 0.323223747459} H2 2044 -1 8 {} O 0.0 {0.639960789808 0.514022500561 0.344574105417} O4 2045 -1 1 {} H 0.0 {0.63799600676 0.524358458037 0.344861586118} H3 2046 -1 8 {} O 0.0 {0.679012617005 0.507647877376 0.33325552913} O6 2047 -1 1 {} H 0.0 {0.68694832059 0.510351948184 0.33958590849} H5 2048 -1 1 {} H 0.0 {0.682923757341 0.537249044073 0.338679818358} H6 2049 -1 14 {} Si 0.0 {0.429044017538 0.474984840483 0.272826216673} Si1 2050 -1 8 {} O 0.0 {0.42072871524 0.479760967637 0.288509456743} O1 2051 -1 14 {} Si 0.0 {0.433073909195 0.487664767667 0.299573101529} Si2 2052 -1 8 {} O 0.0 {0.435631994082 0.505127527281 0.294369163637} O2 2053 -1 1 {} H 0.0 {0.442283155095 0.509808108655 0.300994890989} H1 2054 -1 8 {} O 0.0 {0.427008511518 0.487256620047 0.316947321275} O3 2055 -1 1 {} H 0.0 {0.420240091966 0.479317688567 0.318094768873} H2 2056 -1 8 {} O 0.0 {0.448992114309 0.478505218047 0.298388711655} O4 2057 -1 1 {} H 0.0 {0.455987357613 0.482790708966 0.304917034086} H3 2058 -1 8 {} O 0.0 {0.424133058997 0.486635473259 0.259469890652} O5 2059 -1 1 {} H 0.0 {0.43258978443 0.489176043128 0.253782406231} H4 2060 -1 8 {} O 0.0 {0.424120573523 0.457874384565 0.268190562826} O6 2061 -1 1 {} H 0.0 {0.413682391548 0.4569673677 0.268778659646} H5 2062 -1 8 {} O 0.0 {0.447285543597 0.475714525891 0.275165199122} O7 2063 -1 1 {} H 0.0 {0.451073928435 0.465977331759 0.276143876794} H6 2064 -1 14 {} Si 0.0 {0.560601680403 0.526823714811 0.476500807518} Si1 2065 -1 8 {} O 0.0 {0.555349577542 0.541830058899 0.485736521864} O1 2066 -1 14 {} Si 0.0 {0.569676305689 0.548397980858 0.4952278436} Si2 2067 -1 8 {} O 0.0 {0.584939841499 0.539445886174 0.490149222511} O2 2068 -1 1 {} H 0.0 {0.592331306162 0.540716933887 0.497486194662} H1 2069 -1 8 {} O 0.0 {0.571666166769 0.566349214682 0.491740356287} O3 2070 -1 1 {} H 0.0 {0.563806096745 0.571662201798 0.496236279672} H2 2071 -1 8 {} O 0.0 {0.566793234941 0.54590351315 0.513232722258} O4 2072 -1 1 {} H 0.0 {0.568531463736 0.535843591506 0.515698678407} H3 2073 -1 8 {} O 0.0 {0.557923810179 0.529423018925 0.458479622113} O5 2074 -1 1 {} H 0.0 {0.556210686119 0.539617666718 0.456647902573} H4 2075 -1 8 {} O 0.0 {0.550757982725 0.512348230597 0.482133298794} O6 2076 -1 1 {} H 0.0 {0.553600821818 0.503850437464 0.476664152397} H5 2077 -1 8 {} O 0.0 {0.578453573238 0.523670055878 0.479650767849} O7 2078 -1 1 {} H 0.0 {0.579901270289 0.521808550679 0.489888147069} H6 2079 -1 14 {} Si 0.0 {0.585722812904 0.62726080839 0.589549043345} Si1 2080 -1 8 {} O 0.0 {0.573400507144 0.619233870307 0.57857212395} O1 2081 -1 14 {} Si 0.0 {0.576294538298 0.624947770231 0.561359413465} Si2 2082 -1 8 {} O 0.0 {0.560307845247 0.6256616174 0.552287119647} O2 2083 -1 1 {} H 0.0 {0.553110610005 0.620048939265 0.557471302018} H1 2084 -1 8 {} O 0.0 {0.583946279207 0.641676124359 0.56180951844} O3 2085 -1 1 {} H 0.0 {0.591095725257 0.642030633261 0.569521326839} H2 2086 -1 8 {} O 0.0 {0.587624029596 0.613273490453 0.552807739199} O4 2087 -1 1 {} H 0.0 {0.584976249009 0.612674943341 0.542661414138} H3 2088 -1 8 {} O 0.0 {0.585435354143 0.645459726925 0.586748305559} O5 2089 -1 1 {} H 0.0 {0.575557670232 0.648545863002 0.584899127043} H4 2090 -1 8 {} O 0.0 {0.602444599136 0.620690601032 0.585605620915} O6 2091 -1 1 {} H 0.0 {0.603334206767 0.610942186741 0.589358719991} H5 2092 -1 8 {} O 0.0 {0.581663595741 0.623697187894 0.607132103389} O7 2093 -1 1 {} H 0.0 {0.589777494973 0.618820840522 0.611669008216} H6 2094 -1 1 {} H 0.0 {0.651309995339 0.421120186083 0.675350622419} H2 2095 -1 14 {} Si 0.0 {0.371835965364 0.596642373361 0.430778549641} Si1 2096 -1 8 {} O 0.0 {0.355512522675 0.589845562254 0.435742390128} O1 2097 -1 14 {} Si 0.0 {0.345720907084 0.586031233666 0.420679038015} Si2 2098 -1 8 {} O 0.0 {0.355538922176 0.575116818306 0.409588993291} O2 2099 -1 1 {} H 0.0 {0.361910161532 0.580996160354 0.403659652511} H1 2100 -1 8 {} O 0.0 {0.330175051798 0.577491573782 0.425522071362} O3 2101 -1 1 {} H 0.0 {0.330553928585 0.575112451946 0.435746025281} H2 2102 -1 8 {} O 0.0 {0.341676697792 0.601674639072 0.411875247534} O4 2103 -1 1 {} H 0.0 {0.350304438041 0.607628026901 0.411200806381} H3 2104 -1 8 {} O 0.0 {0.378608693565 0.6068697983 0.444477617147} O5 2105 -1 1 {} H 0.0 {0.376708719953 0.602107934003 0.453643768245} H4 2106 -1 8 {} O 0.0 {0.36982325018 0.60703723132 0.41573266359} O6 2107 -1 1 {} H 0.0 {0.369876105536 0.600887864252 0.407214305682} H5 2108 -1 8 {} O 0.0 {0.383383912705 0.582796074803 0.427152843881} O7 2109 -1 1 {} H 0.0 {0.383004332372 0.580540492371 0.416903588366} H6 2110 -1 14 {} Si 0.0 {0.387446301383 0.339178168332 0.341636407242} Si1 2111 -1 8 {} O 0.0 {0.380925219006 0.322947392517 0.34727702361} O1 2112 -1 8 {} O 0.0 {0.394420927068 0.302033519502 0.363983571811} O2 2113 -1 1 {} H 0.0 {0.394445829307 0.309117022392 0.371738498294} H1 2114 -1 8 {} O 0.0 {0.410696587105 0.319437631068 0.345640976723} O4 2115 -1 1 {} H 0.0 {0.416209786229 0.318840564851 0.354546089054} H3 2116 -1 1 {} H 0.0 {0.377660179527 0.354718569375 0.326200910936} H4 2117 -1 8 {} O 0.0 {0.405456550275 0.337690585491 0.338191778204} O6 2118 -1 1 {} H 0.0 {0.410866110675 0.342531464718 0.345770670102} H5 2119 -1 8 {} O 0.0 {0.384712485827 0.35179340589 0.35474366485} O7 2120 -1 1 {} H 0.0 {0.392748917341 0.358548063375 0.354812714259} H6 2121 -1 1 {} H 0.0 {0.403842263377 0.35957737205 0.309405251707} H3 2122 -1 8 {} O 0.0 {0.379294475204 0.375839335836 0.324831853178} O7 2123 -1 1 {} H 0.0 {0.373461563673 0.374333350027 0.333430346523} H6 2124 -1 14 {} Si 0.0 {0.535195715198 0.659033738457 0.598948108205} Si1 2125 -1 8 {} O 0.0 {0.552746515811 0.656977075015 0.603985516296} O1 2126 -1 14 {} Si 0.0 {0.553793456373 0.657031429903 0.622326704386} Si2 2127 -1 8 {} O 0.0 {0.552047252128 0.639838351218 0.628575607706} O2 2128 -1 1 {} H 0.0 {0.548335136556 0.633701795358 0.620906219349} H1 2129 -1 8 {} O 0.0 {0.570066542888 0.66383756581 0.627544042779} O3 2130 -1 1 {} H 0.0 {0.576406618505 0.664479076718 0.619205117686} H2 2131 -1 8 {} O 0.0 {0.540285290703 0.667468234042 0.629206843576} O4 2132 -1 1 {} H 0.0 {0.532147170425 0.661368214453 0.631815957222} H3 2133 -1 8 {} O 0.0 {0.527407572824 0.672152424954 0.609223018306} O5 2134 -1 1 {} H 0.0 {0.534894999669 0.678251243052 0.613347655566} H4 2135 -1 8 {} O 0.0 {0.526197490728 0.643166879934 0.601413835873} O6 2136 -1 1 {} H 0.0 {0.518421604226 0.644602797431 0.60833016995} H5 2137 -1 8 {} O 0.0 {0.534441820962 0.663853395572 0.581210192982} O7 2138 -1 1 {} H 0.0 {0.542726487018 0.669845920234 0.578877429085} H6 2139 -1 14 {} Si 0.0 {0.557674710149 0.427744781797 0.532189945892} Si1 2140 -1 8 {} O 0.0 {0.548350839873 0.432350068778 0.517047580524} O1 2141 -1 14 {} Si 0.0 {0.539617026262 0.448239681232 0.519969821932} Si2 2142 -1 8 {} O 0.0 {0.538191874227 0.451212920344 0.538064123337} O2 2143 -1 1 {} H 0.0 {0.538987268528 0.44207829881 0.543167896755} H1 2144 -1 8 {} O 0.0 {0.549148383308 0.46190942259 0.512279636564} O3 2145 -1 1 {} H 0.0 {0.559339162146 0.459415959394 0.512134655161} H2 2146 -1 8 {} O 0.0 {0.522810210954 0.447489924048 0.512523740787} O4 2147 -1 1 {} H 0.0 {0.515740881063 0.450830261605 0.519533349334} H3 2148 -1 8 {} O 0.0 {0.55906518544 0.442410159214 0.543213866962} O5 2149 -1 1 {} H 0.0 {0.554269615997 0.440386499966 0.552329470073} H4 2150 -1 8 {} O 0.0 {0.574502004772 0.421970531771 0.527527762627} O6 2151 -1 1 {} H 0.0 {0.58053824716 0.421551227706 0.53610577028} H5 2152 -1 8 {} O 0.0 {0.54876241396 0.414277361244 0.540988018152} O7 2153 -1 1 {} H 0.0 {0.554441782879 0.4054660762 0.540535715497} H6 2154 -1 14 {} Si 0.0 {0.289897239997 0.490214772224 0.57847244221} Si1 2155 -1 8 {} O 0.0 {0.305953488336 0.481898813978 0.57512071558} O1 2156 -1 14 {} Si 0.0 {0.316930620108 0.493405780562 0.56590522665} Si2 2157 -1 8 {} O 0.0 {0.328893520483 0.501083178996 0.577563673964} O2 2158 -1 1 {} H 0.0 {0.329325148445 0.495397282192 0.586369804013} H1 2159 -1 8 {} O 0.0 {0.326102713781 0.484122634467 0.552934511651} O3 2160 -1 1 {} H 0.0 {0.319857223302 0.476738886328 0.548854741881} H2 2161 -1 8 {} O 0.0 {0.306752839834 0.506550088268 0.558012285398} O4 2162 -1 1 {} H 0.0 {0.30076256383 0.511168170873 0.565298013352} H3 2163 -1 8 {} O 0.0 {0.28076028959 0.492474449274 0.562664909604} O5 2164 -1 1 {} H 0.0 {0.278925918241 0.483086613806 0.558335727811} H4 2165 -1 8 {} O 0.0 {0.292986617051 0.506648653473 0.586166208395} O6 2166 -1 1 {} H 0.0 {0.289545215284 0.506552792645 0.59608704682} H5 2167 -1 8 {} O 0.0 {0.279892130519 0.479879997473 0.589916201233} O7 2168 -1 1 {} H 0.0 {0.274138477705 0.486099673414 0.596111760683} H6 2169 -1 14 {} Si 0.0 {0.5869402622 0.339623180159 0.561785027865} Si1 2170 -1 8 {} O 0.0 {0.602965070449 0.331996077413 0.556874825747} O1 2171 -1 14 {} Si 0.0 {0.616726561408 0.343519019246 0.560935748354} Si2 2172 -1 8 {} O 0.0 {0.613671229579 0.359744722308 0.552897107101} O2 2173 -1 1 {} H 0.0 {0.60414693149 0.359696511969 0.548513546477} H1 2174 -1 8 {} O 0.0 {0.617637978915 0.345794553696 0.579101652699} O3 2175 -1 1 {} H 0.0 {0.626805522517 0.350283450821 0.581588377881} H2 2176 -1 8 {} O 0.0 {0.632619592972 0.336553130392 0.554880981508} O4 2177 -1 1 {} H 0.0 {0.634892556134 0.340689267835 0.545516874891} H3 2178 -1 8 {} O 0.0 {0.573820199848 0.334540891212 0.549992116337} O5 2179 -1 1 {} H 0.0 {0.564405247063 0.336006999835 0.554421032998} H4 2180 -1 8 {} O 0.0 {0.588527049141 0.357971105078 0.561487442331} O6 2181 -1 1 {} H 0.0 {0.598506977379 0.360645776101 0.563225113516} H5 2182 -1 8 {} O 0.0 {0.582389230741 0.333972420728 0.578742757062} O7 2183 -1 1 {} H 0.0 {0.582322225927 0.342141032953 0.585292366895} H6 2184 -1 14 {} Si 0.0 {0.504019894335 0.39669270073 0.676236488799} Si1 2185 -1 8 {} O 0.0 {0.515390293037 0.39443501355 0.661722503603} O1 2186 -1 14 {} Si 0.0 {0.516749859774 0.3764625726 0.657373864979} Si2 2187 -1 8 {} O 0.0 {0.530823226312 0.373917895755 0.645791705663} O2 2188 -1 1 {} H 0.0 {0.534918115202 0.383206434877 0.643164398271} H1 2189 -1 8 {} O 0.0 {0.51953949437 0.366567320254 0.672631513505} O3 2190 -1 1 {} H 0.0 {0.511874969887 0.359444110142 0.673607514908} H2 2191 -1 8 {} O 0.0 {0.501227858191 0.370886295861 0.649291914214} O4 2192 -1 1 {} H 0.0 {0.501104089088 0.374190515904 0.63933730719} H3 2193 -1 8 {} O 0.0 {0.488301568914 0.387626428331 0.673204857758} O5 2194 -1 1 {} H 0.0 {0.485573751325 0.382385379677 0.681886421009} H4 2195 -1 8 {} O 0.0 {0.500433550393 0.414597960773 0.678494763811} O6 2196 -1 1 {} H 0.0 {0.503660099066 0.417629758942 0.688024650546} H5 2197 -1 8 {} O 0.0 {0.511933596592 0.39014198625 0.691525644784} O7 2198 -1 1 {} H 0.0 {0.505339922347 0.391315516495 0.699649735601} H6 2199 -1 14 {} Si 0.0 {0.304351080388 0.340571803514 0.485993157427} Si1 2200 -1 8 {} O 0.0 {0.304717310949 0.349810617444 0.501979111014} O1 2201 -1 8 {} O 0.0 {0.292313208582 0.352387491596 0.529546452176} O4 2202 -1 1 {} H 0.0 {0.295012199767 0.362255290891 0.52722673562} H3 2203 -1 8 {} O 0.0 {0.319150301718 0.345043815711 0.475976569814} O6 2204 -1 1 {} H 0.0 {0.321585810726 0.355126427407 0.477638234507} H5 2205 -1 1 {} H 0.0 {0.288577921614 0.355445422133 0.475751000085} H6 2206 -1 14 {} Si 0.0 {0.474819282563 0.692862395758 0.392049819915} Si1 2207 -1 8 {} O 0.0 {0.471008912988 0.684651339358 0.407956114618} O1 2208 -1 14 {} Si 0.0 {0.483999758652 0.672250100991 0.411284009958} Si2 2209 -1 8 {} O 0.0 {0.489363036278 0.673427947765 0.428877932034} O2 2210 -1 1 {} H 0.0 {0.486924738064 0.682896365513 0.432643954972} H1 2211 -1 8 {} O 0.0 {0.477403734592 0.655350301078 0.408008709977} O3 2212 -1 1 {} H 0.0 {0.468261404049 0.654141187198 0.412981122888} H2 2213 -1 8 {} O 0.0 {0.498422965982 0.675400507004 0.400265422814} O4 2214 -1 1 {} H 0.0 {0.500500896712 0.685685062403 0.400075162093} H3 2215 -1 8 {} O 0.0 {0.491981691155 0.699445131124 0.3925825384} O5 2216 -1 1 {} H 0.0 {0.49380624309 0.705092103944 0.38395396219} H4 2217 -1 8 {} O 0.0 {0.463005229977 0.706641265593 0.389277740504} O6 2218 -1 1 {} H 0.0 {0.454434180951 0.702951995714 0.384489225803} H5 2219 -1 8 {} O 0.0 {0.473380285727 0.680617280234 0.378395307659} O7 2220 -1 1 {} H 0.0 {0.467389129841 0.684596029761 0.370768714409} H6 2221 -1 14 {} Si 0.0 {0.697017966738 0.539770755403 0.458323168883} Si1 2222 -1 8 {} O 0.0 {0.703021816128 0.55030876468 0.4444482761} O1 2223 -1 14 {} Si 0.0 {0.702410116327 0.568067234279 0.449347421619} Si2 2224 -1 8 {} O 0.0 {0.70861662032 0.569936048935 0.466567460419} O2 2225 -1 1 {} H 0.0 {0.701482719574 0.566168182185 0.473276243021} H1 2226 -1 8 {} O 0.0 {0.712980084653 0.577902912624 0.43794103325} O3 2227 -1 1 {} H 0.0 {0.709937884136 0.576205249325 0.428033727322} H2 2228 -1 8 {} O 0.0 {0.685065749564 0.574163891433 0.448367222844} O4 2229 -1 1 {} H 0.0 {0.678455630014 0.566155803751 0.449873908431} H3 2230 -1 8 {} O 0.0 {0.683485669761 0.528882623485 0.452300220301} O5 2231 -1 1 {} H 0.0 {0.686114216897 0.524899923887 0.442943060447} H4 2232 -1 8 {} O 0.0 {0.690720816407 0.55044228677 0.471919912796} O6 2233 -1 1 {} H 0.0 {0.695709394004 0.548022745936 0.480842535813} H5 2234 -1 8 {} O 0.0 {0.710845798346 0.529374816537 0.464593654401} O7 2235 -1 1 {} H 0.0 {0.7198531446 0.534691722038 0.463790689993} H6 2236 -1 14 {} Si 0.0 {0.677047736123 0.589377628671 0.630787507846} Si2 2237 -1 8 {} O 0.0 {0.66272425017 0.577979969214 0.628830236684} O2 2238 -1 1 {} H 0.0 {0.653836784626 0.583567993104 0.628457541771} H1 2239 -1 8 {} O 0.0 {0.683135152773 0.594447423491 0.614168267834} O3 2240 -1 1 {} H 0.0 {0.679125959683 0.603832117409 0.611688282799} H2 2241 -1 14 {} Si 0.0 {0.580863550581 0.331290035457 0.614202852499} Si1 2242 -1 8 {} O 0.0 {0.589745818593 0.337025530806 0.599085844317} O1 2243 -1 14 {} Si 0.0 {0.607947569518 0.33637458775 0.60189459696} Si2 2244 -1 8 {} O 0.0 {0.614724270192 0.320987973567 0.594371287296} O2 2245 -1 1 {} H 0.0 {0.62214300313 0.317003799049 0.600627857097} H1 2246 -1 8 {} O 0.0 {0.615953047548 0.351037294514 0.594192576066} O3 2247 -1 1 {} H 0.0 {0.608586472445 0.357659784984 0.590753332281} H2 2248 -1 8 {} O 0.0 {0.611396180105 0.336460539189 0.619936855553} O4 2249 -1 1 {} H 0.0 {0.607728626491 0.32765534207 0.624213300836} H3 2250 -1 8 {} O 0.0 {0.577445473615 0.313221215946 0.612963051892} O5 2251 -1 1 {} H 0.0 {0.586471866005 0.307899622494 0.613443404314} H4 2252 -1 8 {} O 0.0 {0.564933182015 0.340358630436 0.615723598255} O6 2253 -1 1 {} H 0.0 {0.566844795865 0.350567049668 0.617163186531} H5 2254 -1 8 {} O 0.0 {0.591240860634 0.334559795104 0.629006208504} O7 2255 -1 1 {} H 0.0 {0.585173533985 0.338165027836 0.636758386957} H6 2256 -1 14 {} Si 0.0 {0.41472473424 0.449188284751 0.582435493245} Si1 2257 -1 8 {} O 0.0 {0.427504254988 0.438485767082 0.59009176727} O1 2258 -1 14 {} Si 0.0 {0.419265128152 0.427579111148 0.602226930552} Si2 2259 -1 8 {} O 0.0 {0.42996793851 0.425581352528 0.617042667308} O2 2260 -1 1 {} H 0.0 {0.433691289903 0.434955239278 0.619931588221} H1 2261 -1 8 {} O 0.0 {0.403249562013 0.435275413649 0.607141435349} O3 2262 -1 1 {} H 0.0 {0.398093334065 0.438383122313 0.598525545799} H2 2263 -1 8 {} O 0.0 {0.416203399763 0.411120706698 0.594543004935} O4 2264 -1 1 {} H 0.0 {0.421076303023 0.410652318631 0.585234297111} H3 2265 -1 8 {} O 0.0 {0.406171833605 0.458833137702 0.595572739272} O5 2266 -1 1 {} H 0.0 {0.412355778963 0.466704324642 0.59871874692} H4 2267 -1 8 {} O 0.0 {0.402453924867 0.438676947318 0.573629581988} O6 2268 -1 1 {} H 0.0 {0.404179347773 0.439202369874 0.563299079664} H5 2269 -1 8 {} O 0.0 {0.422666576951 0.460692105249 0.570534934064} O7 2270 -1 1 {} H 0.0 {0.416483386665 0.469047676486 0.569150648023} H6 2271 -1 14 {} Si 0.0 {0.597284684167 0.586168488279 0.678555131054} Si1 2272 -1 8 {} O 0.0 {0.583817610595 0.577149283758 0.687169449481} O1 2273 -1 14 {} Si 0.0 {0.581616814717 0.584386183638 0.703895780406} Si2 2274 -1 8 {} O 0.0 {0.56926389477 0.574540691654 0.713288316103} O2 2275 -1 1 {} H 0.0 {0.562454026983 0.570194339319 0.706590596129} H1 2276 -1 8 {} O 0.0 {0.575729815191 0.601734865684 0.702280968142} O4 2277 -1 1 {} H 0.0 {0.570189935317 0.602724971985 0.693417706599} H3 2278 -1 8 {} O 0.0 {0.603517930505 0.576030788279 0.664538101196} O5 2279 -1 1 {} H 0.0 {0.599282606997 0.579497535035 0.655582353588} H4 2280 -1 8 {} O 0.0 {0.610961766501 0.589376598447 0.690398798414} O6 2281 -1 8 {} O 0.0 {0.590844835964 0.602179061033 0.672205363988} O7 2282 -1 1 {} H 0.0 {0.593892652575 0.609936803378 0.678599181357} H6 2283 -1 14 {} Si 0.0 {0.581890126697 0.321414669853 0.484271859298} Si1 2284 -1 8 {} O 0.0 {0.578257265409 0.338293667136 0.490676457601} O1 2285 -1 14 {} Si 0.0 {0.58282081044 0.33918492797 0.508477396603} Si2 2286 -1 8 {} O 0.0 {0.575467891647 0.324905830481 0.517326405982} O2 2287 -1 1 {} H 0.0 {0.576963569978 0.316172722261 0.511734385109} H1 2288 -1 8 {} O 0.0 {0.601132331007 0.338630490843 0.510243261603} O3 2289 -1 1 {} H 0.0 {0.605552762367 0.344470922246 0.502740112146} H2 2290 -1 8 {} O 0.0 {0.576427319574 0.35487736031 0.515684731272} O4 2291 -1 1 {} H 0.0 {0.567692642728 0.352905249675 0.52116887699} H3 2292 -1 8 {} O 0.0 {0.586363499728 0.310340549081 0.498270162477} O5 2293 -1 1 {} H 0.0 {0.579546417755 0.302363790859 0.49872869496} H4 2294 -1 8 {} O 0.0 {0.595921191123 0.322260245772 0.472414619541} O6 2295 -1 1 {} H 0.0 {0.592200171264 0.322157881787 0.462600831748} H5 2296 -1 8 {} O 0.0 {0.567026745832 0.314765424409 0.475704037325} O7 2297 -1 1 {} H 0.0 {0.569742320582 0.311365509247 0.46614686225} H6 2298 -1 14 {} Si 0.0 {0.536138709229 0.438632707983 0.415115113301} Si1 2299 -1 8 {} O 0.0 {0.542325730477 0.45476249732 0.421582946053} O1 2300 -1 14 {} Si 0.0 {0.547780436823 0.452928472177 0.439099228495} Si2 2301 -1 8 {} O 0.0 {0.5334685401 0.455722140388 0.450314862148} O2 2302 -1 1 {} H 0.0 {0.528597309389 0.464624362012 0.447607880206} H1 2303 -1 8 {} O 0.0 {0.554487482522 0.43600460769 0.441781519077} O3 2304 -1 1 {} H 0.0 {0.564891136304 0.436105501057 0.440331560053} H2 2305 -1 8 {} O 0.0 {0.560875450299 0.465345213756 0.442726254038} O4 2306 -1 1 {} H 0.0 {0.556717685165 0.474988354094 0.442432261971} H3 2307 -1 8 {} O 0.0 {0.52097490542 0.441519322146 0.405079147086} O5 2308 -1 1 {} H 0.0 {0.5133837615 0.435001437337 0.408252709545} H4 2309 -1 8 {} O 0.0 {0.532182847107 0.42738949094 0.429134563428} O6 2310 -1 1 {} H 0.0 {0.537354339909 0.418322530399 0.427899815777} H5 2311 -1 8 {} O 0.0 {0.549057262865 0.430905940915 0.404532285856} O7 2312 -1 1 {} H 0.0 {0.557901746955 0.42979841055 0.410071174245} H6 2313 -1 14 {} Si 0.0 {0.548798216856 0.64360752579 0.438914181479} Si1 2314 -1 8 {} O 0.0 {0.562155447283 0.644476223406 0.451719305814} O1 2315 -1 14 {} Si 0.0 {0.564064775951 0.628768863906 0.461399383129} Si2 2316 -1 8 {} O 0.0 {0.57799169115 0.618966831396 0.454405615428} O2 2317 -1 1 {} H 0.0 {0.581160285512 0.623327933056 0.445396353627} H1 2318 -1 8 {} O 0.0 {0.567920800722 0.633071708714 0.478827125779} O3 2319 -1 1 {} H 0.0 {0.558969581333 0.634885234651 0.484034310613} H2 2320 -1 8 {} O 0.0 {0.548687002184 0.618695851324 0.461079098883} O4 2321 -1 1 {} H 0.0 {0.551028838805 0.608695432565 0.463338032993} H3 2322 -1 8 {} O 0.0 {0.553993691521 0.653566496266 0.424341942224} O5 2323 -1 1 {} H 0.0 {0.561567886112 0.648480621201 0.41916855593} H4 2324 -1 8 {} O 0.0 {0.533212798872 0.650673777084 0.445757643678} O6 2325 -1 1 {} H 0.0 {0.52838234243 0.643484022479 0.451690409068} H5 2326 -1 8 {} O 0.0 {0.545703597856 0.626320657045 0.433438771413} O7 2327 -1 1 {} H 0.0 {0.535364345544 0.624450229435 0.433658170166} H6 2328 -1 8 {} O 0.0 {0.460524901051 0.727598603541 0.440735410714} O1 2329 -1 8 {} O 0.0 {0.45836352173 0.714307987674 0.413883441721} O2 2330 -1 1 {} H 0.0 {0.455765681473 0.70650939597 0.420416005739} H1 2331 -1 14 {} Si 0.0 {0.616549542435 0.447077062355 0.702722803322} Si1 2332 -1 8 {} O 0.0 {0.627827646054 0.450759446969 0.688729657631} O5 2333 -1 1 {} H 0.0 {0.6242823111 0.445971532442 0.680082013641} H4 2334 -1 8 {} O 0.0 {0.609123776547 0.462711120887 0.708802776475} O6 2335 -1 1 {} H 0.0 {0.600347817658 0.464767655332 0.70337170951} H5 2336 -1 8 {} O 0.0 {0.603097055844 0.435988048845 0.696883778191} O7 2337 -1 1 {} H 0.0 {0.59469755019 0.441734987636 0.694299499618} H6 2338 -1 14 {} Si 0.0 {0.472736576665 0.265242284808 0.601543738979} Si1 2339 -1 8 {} O 0.0 {0.470088924113 0.261111045397 0.583838699071} O1 2340 -1 8 {} O 0.0 {0.482500339813 0.280779484477 0.602973972653} O6 2341 -1 1 {} H 0.0 {0.486943275789 0.282983552548 0.593737340719} H5 2342 -1 14 {} Si 0.0 {0.496448852702 0.639917388204 0.628912741742} Si1 2343 -1 8 {} O 0.0 {0.513286110496 0.647176287121 0.630040365647} O1 2344 -1 14 {} Si 0.0 {0.516647665784 0.651834488913 0.647491753415} Si2 2345 -1 8 {} O 0.0 {0.511205456298 0.638228141324 0.658601669095} O2 2346 -1 1 {} H 0.0 {0.500965370559 0.639307035226 0.660669578111} H1 2347 -1 8 {} O 0.0 {0.534671048165 0.654759089242 0.649714881041} O3 2348 -1 1 {} H 0.0 {0.54005630672 0.647200422018 0.644814898906} H2 2349 -1 8 {} O 0.0 {0.507361580224 0.66715364182 0.651620336} O4 2350 -1 1 {} H 0.0 {0.504612901657 0.666948066767 0.66174622666} H3 2351 -1 8 {} O 0.0 {0.489123399213 0.63889707914 0.645754526045} O5 2352 -1 1 {} H 0.0 {0.480430038461 0.633035452248 0.645420676696} H4 2353 -1 8 {} O 0.0 {0.497504701379 0.623048126519 0.621647403269} O6 2354 -1 1 {} H 0.0 {0.496098070602 0.623630676011 0.611261697677} H5 2355 -1 8 {} O 0.0 {0.485884745851 0.650562712955 0.618275940351} O7 2356 -1 1 {} H 0.0 {0.491459326607 0.658818509296 0.614966000525} H6 2357 -1 14 {} Si 0.0 {0.708200560897 0.536767902966 0.388882907072} Si1 2358 -1 8 {} O 0.0 {0.708598175517 0.554298864414 0.394572945439} O1 2359 -1 14 {} Si 0.0 {0.691551213301 0.559984311098 0.39868504481} Si2 2360 -1 8 {} O 0.0 {0.691633136622 0.568076659105 0.415203358294} O2 2361 -1 1 {} H 0.0 {0.697491611255 0.562425056053 0.421831012845} H1 2362 -1 8 {} O 0.0 {0.685869610588 0.572051595521 0.38599996657} O3 2363 -1 1 {} H 0.0 {0.690048197484 0.569577205588 0.376696156344} H2 2364 -1 8 {} O 0.0 {0.680127818304 0.545568388187 0.398996523016} O4 2365 -1 1 {} H 0.0 {0.675316387435 0.545146140692 0.408327801647} H3 2366 -1 8 {} O 0.0 {0.701333327479 0.526074753381 0.402199839683} O5 2367 -1 1 {} H 0.0 {0.694670252346 0.531656882764 0.408073103349} H4 2368 -1 8 {} O 0.0 {0.697652528949 0.535385095409 0.373871487854} O7 2369 -1 1 {} H 0.0 {0.696075146415 0.52524094813 0.371637694726} H6 2370 -1 14 {} Si 0.0 {0.626198228204 0.469917211634 0.429623859843} Si1 2371 -1 8 {} O 0.0 {0.630944240772 0.483264319445 0.441424442812} O1 2372 -1 14 {} Si 0.0 {0.643063380721 0.476723488308 0.45365884305} Si2 2373 -1 8 {} O 0.0 {0.645909566991 0.489273720179 0.466841534557} O2 2374 -1 1 {} H 0.0 {0.64308297222 0.498752929439 0.463304310106} H1 2375 -1 8 {} O 0.0 {0.636447722156 0.46129369134 0.461175471765} O3 2376 -1 1 {} H 0.0 {0.626880690252 0.459343863538 0.457299997436} H2 2377 -1 8 {} O 0.0 {0.658980086187 0.473098785086 0.445208346935} O4 2378 -1 1 {} H 0.0 {0.6621133971 0.481595808333 0.439902123585} H3 2379 -1 8 {} O 0.0 {0.626160095962 0.476627370406 0.41248318231} O5 2380 -1 1 {} H 0.0 {0.631127850131 0.46993294468 0.40609864231} H4 2381 -1 8 {} O 0.0 {0.609373284081 0.46372447063 0.433794135038} O6 2382 -1 1 {} H 0.0 {0.609999939475 0.457110261255 0.441920672355} H5 2383 -1 8 {} O 0.0 {0.638284615168 0.456083215297 0.430762077944} O7 2384 -1 1 {} H 0.0 {0.635163553039 0.449321491887 0.438163956425} H6 2385 -1 14 {} Si 0.0 {0.567972735443 0.601900007227 0.614256372189} Si1 2386 -1 8 {} O 0.0 {0.570295555375 0.616290653451 0.625433958788} O1 2387 -1 14 {} Si 0.0 {0.558810212502 0.614633639017 0.639644954646} Si2 2388 -1 8 {} O 0.0 {0.568138971674 0.609041772783 0.654470419771} O2 2389 -1 1 {} H 0.0 {0.562818148398 0.601349378855 0.659234461824} H1 2390 -1 8 {} O 0.0 {0.550891501695 0.630870260144 0.643115430301} O3 2391 -1 1 {} H 0.0 {0.540456998956 0.629748755522 0.643090081943} H2 2392 -1 8 {} O 0.0 {0.545877930081 0.602215967684 0.635509398469} O4 2393 -1 1 {} H 0.0 {0.546209794433 0.594389730638 0.642493223825} H3 2394 -1 8 {} O 0.0 {0.581151456696 0.589465930609 0.61745864123} O5 2395 -1 1 {} H 0.0 {0.579664865146 0.58516648519 0.626936673484} H4 2396 -1 8 {} O 0.0 {0.568792175259 0.607491278103 0.596754063629} O6 2397 -1 1 {} H 0.0 {0.5590654306 0.608880469915 0.593088228714} H5 2398 -1 8 {} O 0.0 {0.551537656414 0.594319563413 0.617451794785} O7 2399 -1 1 {} H 0.0 {0.548175758323 0.589516713591 0.60875376926} H6 2400 -1 14 {} Si 0.0 {0.371779751938 0.544617810415 0.381576322337} Si1 2401 -1 8 {} O 0.0 {0.358138459082 0.551334048557 0.391978365015} O1 2402 -1 14 {} Si 0.0 {0.346994406777 0.537688421568 0.397352863683} Si2 2403 -1 8 {} O 0.0 {0.347980651528 0.523767436058 0.385384656175} O2 2404 -1 1 {} H 0.0 {0.347957518968 0.52754888557 0.375629158913} H1 2405 -1 8 {} O 0.0 {0.352057714968 0.531847871845 0.414059366077} O3 2406 -1 1 {} H 0.0 {0.352140313657 0.539974934623 0.420720845844} H2 2407 -1 8 {} O 0.0 {0.32970796317 0.543875065719 0.398020445903} O4 2408 -1 1 {} H 0.0 {0.328666934037 0.551974766596 0.391433281378} H3 2409 -1 8 {} O 0.0 {0.375589152864 0.556538552224 0.368089294934} O5 2410 -1 1 {} H 0.0 {0.383412836845 0.562854755457 0.371128778191} H4 2411 -1 8 {} O 0.0 {0.366676820904 0.528520931274 0.374272877941} O6 2412 -1 1 {} H 0.0 {0.375236957856 0.522987430757 0.371721569081} H5 2413 -1 8 {} O 0.0 {0.386751029194 0.542159311967 0.391955303398} O7 2414 -1 1 {} H 0.0 {0.383889556281 0.541047558322 0.401990037681} H6 2415 -1 8 {} O 0.0 {0.712035399342 0.377430899382 0.543822157592} O1 2416 -1 8 {} O 0.0 {0.706136125057 0.380270767224 0.573110389344} O3 2417 -1 8 {} O 0.0 {0.703349975213 0.355438098325 0.525374594652} O5 2418 -1 1 {} H 0.0 {0.695072593303 0.361833383939 0.526304708538} H4 2419 -1 14 {} Si 0.0 {0.460598379073 0.271243009519 0.499265802075} Si1 2420 -1 8 {} O 0.0 {0.474153585721 0.282974043972 0.494220147825} O1 2421 -1 14 {} Si 0.0 {0.476306659664 0.283667576566 0.475764521044} Si2 2422 -1 8 {} O 0.0 {0.482742673915 0.300212534892 0.470964977596} O2 2423 -1 1 {} H 0.0 {0.476528540411 0.307647936445 0.474882701221} H1 2424 -1 8 {} O 0.0 {0.488543106107 0.271008865306 0.470603827396} O3 2425 -1 1 {} H 0.0 {0.495069448984 0.26902069461 0.478550997181} H2 2426 -1 8 {} O 0.0 {0.460205963321 0.28074854281 0.467230827994} O4 2427 -1 1 {} H 0.0 {0.457612427836 0.289258549892 0.461622186122} H3 2428 -1 8 {} O 0.0 {0.458293339255 0.258045652024 0.486526506316} O5 2429 -1 1 {} H 0.0 {0.463995596774 0.249640335287 0.489130878896} H4 2430 -1 8 {} O 0.0 {0.444864720493 0.280753111415 0.501382353097} O6 2431 -1 1 {} H 0.0 {0.438720894822 0.275992332161 0.508480982249} H5 2432 -1 8 {} O 0.0 {0.465151881514 0.263210667101 0.515212286478} O7 2433 -1 1 {} H 0.0 {0.456662210504 0.258685659576 0.519462634951} H6 2434 -1 14 {} Si 0.0 {0.30383243719 0.496627557504 0.640683857467} Si1 2435 -1 8 {} O 0.0 {0.294798960119 0.490850437186 0.607752935368} O3 2436 -1 1 {} H 0.0 {0.297796763748 0.480789476186 0.607924450857} H2 2437 -1 8 {} O 0.0 {0.312950431389 0.487574723238 0.653840397771} O5 2438 -1 1 {} H 0.0 {0.317890188803 0.494475542916 0.660027323208} H4 2439 -1 1 {} H 0.0 {0.307837605202 0.520103621838 0.643814044344} H5 2440 -1 8 {} O 0.0 {0.314200289084 0.497483980698 0.625507184066} O7 2441 -1 1 {} H 0.0 {0.314497059152 0.488028747696 0.620943261101} H6 2442 -1 8 {} O 0.0 {0.443932974341 0.258375830106 0.461972885358} O1 2443 -1 14 {} Si 0.0 {0.460384547877 0.255356233564 0.454369966289} Si2 2444 -1 8 {} O 0.0 {0.467836968051 0.271439465071 0.449260171808} O3 2445 -1 1 {} H 0.0 {0.47729928117 0.272521244823 0.453698987293} H2 2446 -1 8 {} O 0.0 {0.471304967202 0.246961191978 0.466584879118} O4 2447 -1 14 {} Si 0.0 {0.420988012271 0.548713702761 0.49767147277} Si1 2448 -1 8 {} O 0.0 {0.430857966406 0.534816272824 0.490703445606} O1 2449 -1 14 {} Si 0.0 {0.428074331201 0.519422069036 0.500462985745} Si2 2450 -1 8 {} O 0.0 {0.410185151981 0.517638590244 0.50445580302} O2 2451 -1 1 {} H 0.0 {0.405908968422 0.527123540888 0.50568328277} H1 2452 -1 8 {} O 0.0 {0.43353746454 0.504965588096 0.490479690909} O3 2453 -1 1 {} H 0.0 {0.443051068424 0.50690581054 0.486465173325} H2 2454 -1 8 {} O 0.0 {0.437837983867 0.520152451522 0.516074477764} O4 2455 -1 1 {} H 0.0 {0.431892102869 0.524191162106 0.523739770719} H3 2456 -1 8 {} O 0.0 {0.404097316966 0.548441237388 0.490467434865} O5 2457 -1 1 {} H 0.0 {0.402536209463 0.539286508203 0.485592218871} H4 2458 -1 8 {} O 0.0 {0.429096943236 0.56465740265 0.493371712584} O6 2459 -1 1 {} H 0.0 {0.435649038295 0.567416061888 0.501037409924} H5 2460 -1 8 {} O 0.0 {0.419924084385 0.547055887366 0.515980803078} O7 2461 -1 1 {} H 0.0 {0.416656525491 0.55614463915 0.520130375779} H6 2462 -1 14 {} Si 0.0 {0.590614784995 0.555331782897 0.456517006202} Si1 2463 -1 8 {} O 0.0 {0.589158980336 0.556554687314 0.438216793084} O1 2464 -1 14 {} Si 0.0 {0.580788335568 0.541510324024 0.431727595369} Si2 2465 -1 8 {} O 0.0 {0.583853663276 0.527386097774 0.443105388631} O2 2466 -1 1 {} H 0.0 {0.59381156599 0.527667509169 0.446399761853} H1 2467 -1 8 {} O 0.0 {0.562704343275 0.54458801335 0.430533451361} O3 2468 -1 1 {} H 0.0 {0.558230786274 0.53690521443 0.424949559634} H2 2469 -1 8 {} O 0.0 {0.587429828017 0.537505762122 0.415045321553} O4 2470 -1 1 {} H 0.0 {0.597368913511 0.534249519786 0.415939509457} H3 2471 -1 8 {} O 0.0 {0.573824018514 0.55415669792 0.463943997413} O5 2472 -1 1 {} H 0.0 {0.572651210894 0.561725252866 0.471125778602} H4 2473 -1 8 {} O 0.0 {0.599150922425 0.570289161732 0.462998728993} O6 2474 -1 1 {} H 0.0 {0.604226818613 0.567845071972 0.471858611309} H5 2475 -1 8 {} O 0.0 {0.600326628419 0.540332149392 0.460910048498} O7 2476 -1 1 {} H 0.0 {0.598917516482 0.538116522954 0.471075595041} H6 2477 -1 14 {} Si 0.0 {0.696097986392 0.496689080302 0.483801569554} Si1 2478 -1 8 {} O 0.0 {0.679741480532 0.493313109981 0.491505144095} O1 2479 -1 14 {} Si 0.0 {0.668315258812 0.507197061626 0.487697433436} Si2 2480 -1 8 {} O 0.0 {0.652807078763 0.505268731101 0.497394542419} O2 2481 -1 1 {} H 0.0 {0.645164174785 0.510890856279 0.49289000319} H1 2482 -1 8 {} O 0.0 {0.67637812234 0.523106168089 0.492142216082} O3 2483 -1 1 {} H 0.0 {0.679341063909 0.522825876977 0.502208749049} H2 2484 -1 8 {} O 0.0 {0.664368573759 0.507115124308 0.469730260045} O4 2485 -1 1 {} H 0.0 {0.664874995052 0.497275310804 0.466095016961} H3 2486 -1 8 {} O 0.0 {0.693694482144 0.501536596282 0.466214083176} O5 2487 -1 1 {} H 0.0 {0.692354830911 0.511935811656 0.465613628345} H4 2488 -1 8 {} O 0.0 {0.706518695958 0.481555125335 0.484629202237} O6 2489 -1 1 {} H 0.0 {0.713947358474 0.482835455799 0.491935220845} H5 2490 -1 8 {} O 0.0 {0.704424017161 0.510381989243 0.492846687918} O7 2491 -1 1 {} H 0.0 {0.707178462598 0.507071936898 0.502421640386} H6 2492 -1 14 {} Si 0.0 {0.307561223428 0.595016351566 0.434579489069} Si1 2493 -1 8 {} O 0.0 {0.31616876388 0.593474473184 0.450784616826} O1 2494 -1 14 {} Si 0.0 {0.308717852388 0.579812746919 0.460608691339} Si2 2495 -1 8 {} O 0.0 {0.319767114475 0.575779144874 0.474743632194} O2 2496 -1 1 {} H 0.0 {0.320126417723 0.565373094492 0.476042789792} H1 2497 -1 8 {} O 0.0 {0.292290699044 0.585075045257 0.467003218173} O3 2498 -1 1 {} H 0.0 {0.292371507156 0.595433055469 0.46869884031} H2 2499 -1 8 {} O 0.0 {0.306700109524 0.564932648099 0.449977235601} O4 2500 -1 1 {} H 0.0 {0.31360421185 0.55758436076 0.45292562046} H3 2501 -1 8 {} O 0.0 {0.316133476957 0.607676679791 0.424399939526} O5 2502 -1 1 {} H 0.0 {0.320982550869 0.60298053693 0.416358053755} H4 2503 -1 8 {} O 0.0 {0.290082135259 0.600121592411 0.437296115037} O6 2504 -1 1 {} H 0.0 {0.288807395449 0.60302718081 0.447299085384} H5 2505 -1 8 {} O 0.0 {0.307943610755 0.578866422647 0.425779312827} O7 2506 -1 1 {} H 0.0 {0.312028089676 0.580224397909 0.416188618262} H6 2507 -1 14 {} Si 0.0 {0.604871744662 0.55841144094 0.316220050004} Si1 2508 -1 8 {} O 0.0 {0.614174164911 0.55540189433 0.331826234687} O1 2509 -1 14 {} Si 0.0 {0.608755516274 0.539483548864 0.339340595857} Si2 2510 -1 8 {} O 0.0 {0.620258766482 0.534944168041 0.352960080789} O2 2511 -1 1 {} H 0.0 {0.628406510257 0.541567457427 0.352992781807} H1 2512 -1 8 {} O 0.0 {0.591738873647 0.541340246326 0.346082850238} O3 2513 -1 1 {} H 0.0 {0.589989496306 0.551406183167 0.348439598272} H2 2514 -1 8 {} O 0.0 {0.608896146649 0.526254232353 0.326546622491} O4 2515 -1 1 {} H 0.0 {0.613828306001 0.517791612786 0.330336266865} H3 2516 -1 8 {} O 0.0 {0.616732096704 0.562020955359 0.302626437065} O5 2517 -1 1 {} H 0.0 {0.612512548426 0.559129203863 0.293459155731} H4 2518 -1 8 {} O 0.0 {0.59362188974 0.572787341895 0.318474328904} O6 2519 -1 1 {} H 0.0 {0.584353557791 0.569426362282 0.322027896244} H5 2520 -1 8 {} O 0.0 {0.594999853693 0.543491891794 0.311936032213} O7 2521 -1 1 {} H 0.0 {0.586475975868 0.543065502419 0.318050079831} H6 2522 -1 8 {} O 0.0 {0.55563507323 0.386565812619 0.279101823843} O1 2523 -1 14 {} Si 0.0 {0.570113864356 0.38979253177 0.289923063075} Si2 2524 -1 8 {} O 0.0 {0.572585150645 0.407944210768 0.291451773005} O2 2525 -1 1 {} H 0.0 {0.574280624567 0.412028084423 0.281924646584} H1 2526 -1 8 {} O 0.0 {0.567062117534 0.382581529124 0.306582706889} O3 2527 -1 1 {} H 0.0 {0.562595157353 0.373139398574 0.305525168464} H2 2528 -1 1 {} H 0.0 {0.567361663431 0.359919771991 0.291520208441} H4 2529 -1 1 {} H 0.0 {0.464982967557 0.537977431495 0.255278639527} H4 2530 -1 14 {} Si 0.0 {0.707924299465 0.523346545143 0.575364479109} Si1 2531 -1 8 {} O 0.0 {0.703751662341 0.517568661205 0.59228053342} O1 2532 -1 14 {} Si 0.0 {0.691756238033 0.503694520038 0.591030490485} Si2 2533 -1 8 {} O 0.0 {0.69330763272 0.495754169602 0.574508852537} O2 2534 -1 1 {} H 0.0 {0.685186453441 0.498606429395 0.568493306622} H1 2535 -1 8 {} O 0.0 {0.695296609138 0.49129971603 0.604148529371} O3 2536 -1 1 {} H 0.0 {0.694202010237 0.495785089606 0.613569150126} H2 2537 -1 8 {} O 0.0 {0.674664348772 0.510168796334 0.593115522197} O4 2538 -1 1 {} H 0.0 {0.669734104964 0.510039424637 0.583847048535} H3 2539 -1 8 {} O 0.0 {0.692875797028 0.530414299906 0.567461125895} O5 2540 -1 1 {} H 0.0 {0.695686208242 0.53784720266 0.560612589227} H4 2541 -1 8 {} O 0.0 {0.71402258858 0.509106046913 0.565437796339} O6 2542 -1 1 {} H 0.0 {0.724002943399 0.507121078818 0.567938430603} H5 2543 -1 8 {} O 0.0 {0.721011265485 0.536219895649 0.576278380299} O7 2544 -1 1 {} H 0.0 {0.729457698103 0.532968738544 0.570964209099} H6 2545 -1 14 {} Si 0.0 {0.57966713187 0.459859724556 0.480496267251} Si1 2546 -1 8 {} O 0.0 {0.588404154393 0.471422344391 0.492172330041} O1 2547 -1 14 {} Si 0.0 {0.590360422624 0.463835272202 0.509082548304} Si2 2548 -1 8 {} O 0.0 {0.582728059319 0.446997027986 0.509443442895} O2 2549 -1 1 {} H 0.0 {0.585855537915 0.441493355735 0.501092710556} H1 2550 -1 8 {} O 0.0 {0.608278786934 0.462681061649 0.513163439722} O3 2551 -1 1 {} H 0.0 {0.612582154519 0.472239331239 0.512754600602} H2 2552 -1 8 {} O 0.0 {0.582040322551 0.474453130013 0.521566045496} O4 2553 -1 1 {} H 0.0 {0.577876240431 0.482806272194 0.516807568816} H3 2554 -1 8 {} O 0.0 {0.580605962222 0.442590986265 0.486726970938} O5 2555 -1 1 {} H 0.0 {0.570955487005 0.438460146426 0.487013158302} H4 2556 -1 8 {} O 0.0 {0.587601209859 0.460766015945 0.463889455743} O6 2557 -1 1 {} H 0.0 {0.580228684321 0.459950799024 0.456444944957} H5 2558 -1 8 {} O 0.0 {0.56201817322 0.464851232757 0.479061849341} O7 2559 -1 1 {} H 0.0 {0.560425511892 0.46938823835 0.469725579149} H6 2560 -1 1 {} H 0.0 {0.386659437052 0.406985048024 0.702123717407} H1 2561 -1 14 {} Si 0.0 {0.448482643329 0.459330837816 0.372572368048} Si1 2562 -1 8 {} O 0.0 {0.437777867036 0.454595310106 0.386788327179} O1 2563 -1 14 {} Si 0.0 {0.448281374486 0.450410751084 0.401330170056} Si2 2564 -1 8 {} O 0.0 {0.465028156686 0.445407312429 0.395594065644} O2 2565 -1 1 {} H 0.0 {0.465343869526 0.434977715748 0.394436821161} H1 2566 -1 8 {} O 0.0 {0.449704281162 0.465100198045 0.412316757531} O3 2567 -1 1 {} H 0.0 {0.444069450995 0.472999781536 0.408322587427} H2 2568 -1 8 {} O 0.0 {0.440593472242 0.436527431591 0.410644740453} O4 2569 -1 1 {} H 0.0 {0.443897898167 0.427395621897 0.406656898658} H3 2570 -1 8 {} O 0.0 {0.439514797791 0.456142113892 0.356821091533} O5 2571 -1 1 {} H 0.0 {0.429970442032 0.460496204716 0.357297168047} H4 2572 -1 8 {} O 0.0 {0.46395851411 0.449380487797 0.372931964536} O6 2573 -1 1 {} H 0.0 {0.471446461633 0.454754669221 0.377959319952} H5 2574 -1 8 {} O 0.0 {0.452650034911 0.477213735817 0.373721251073} O7 2575 -1 1 {} H 0.0 {0.456211957998 0.479352738969 0.383360668522} H6 2576 -1 8 {} O 0.0 {0.53909560887 0.4527372861 0.736119906256} O3 2577 -1 1 {} H 0.0 {0.533148248768 0.461095963312 0.734015449276} H2 2578 -1 14 {} Si 0.0 {0.542615598557 0.586329039939 0.357964817002} Si1 2579 -1 8 {} O 0.0 {0.550037221054 0.570185807013 0.353232647121} O1 2580 -1 14 {} Si 0.0 {0.568159932322 0.572232515018 0.350921113649} Si2 2581 -1 8 {} O 0.0 {0.577117729348 0.562475755551 0.36368184444} O2 2582 -1 1 {} H 0.0 {0.571458406695 0.562257743914 0.372511827521} H1 2583 -1 8 {} O 0.0 {0.572900008776 0.566271377068 0.334199742832} O3 2584 -1 1 {} H 0.0 {0.568775934551 0.572630584275 0.32693487066} H2 2585 -1 8 {} O 0.0 {0.572561827903 0.590014011275 0.35256403528} O4 2586 -1 1 {} H 0.0 {0.56880194954 0.593715674016 0.361642857144} H3 2587 -1 8 {} O 0.0 {0.524357148577 0.584559150365 0.359149866469} O5 2588 -1 1 {} H 0.0 {0.520710322647 0.590961957461 0.366618240763} H4 2589 -1 8 {} O 0.0 {0.546746115842 0.598972652664 0.345239430428} O6 2590 -1 1 {} H 0.0 {0.541922131405 0.596553448115 0.336231343281} H5 2591 -1 8 {} O 0.0 {0.549331620247 0.591626078502 0.374261515703} O7 2592 -1 1 {} H 0.0 {0.555194469835 0.583901878144 0.378287978786} H6 2593 -1 14 {} Si 0.0 {0.424522912525 0.494293834657 0.471308186866} Si1 2594 -1 8 {} O 0.0 {0.42230799124 0.480475278626 0.459358158862} O1 2595 -1 14 {} Si 0.0 {0.438407213555 0.47192173337 0.456744659988} Si2 2596 -1 8 {} O 0.0 {0.445286133288 0.466676172858 0.472973892762} O2 2597 -1 1 {} H 0.0 {0.444433745592 0.474575204121 0.479831662105} H1 2598 -1 8 {} O 0.0 {0.435838541054 0.457115548282 0.446107684569} O3 2599 -1 1 {} H 0.0 {0.426138882553 0.453389993525 0.44759572988} H2 2600 -1 8 {} O 0.0 {0.450205880571 0.48339083892 0.448492405284} O4 2601 -1 1 {} H 0.0 {0.449422010512 0.492916522365 0.452830020266} H3 2602 -1 8 {} O 0.0 {0.440558386775 0.5027030897 0.46806334944} O5 2603 -1 1 {} H 0.0 {0.438753695644 0.512085935315 0.463709972591} H4 2604 -1 8 {} O 0.0 {0.424444525342 0.487639375437 0.488455599127} O6 2605 -1 1 {} H 0.0 {0.428542112838 0.4779774404 0.488470104476} H5 2606 -1 8 {} O 0.0 {0.410763226185 0.506361790041 0.469357042966} O7 2607 -1 1 {} H 0.0 {0.404038761204 0.505316400174 0.477357023832} H6 2608 -1 14 {} Si 0.0 {0.438397751887 0.62181613411 0.520023149622} Si1 2609 -1 8 {} O 0.0 {0.432548394042 0.614961748702 0.535999899142} O1 2610 -1 14 {} Si 0.0 {0.423591382269 0.62816794635 0.544899501208} Si2 2611 -1 8 {} O 0.0 {0.435177845374 0.641952675803 0.548552104044} O2 2612 -1 1 {} H 0.0 {0.438297113409 0.646329710235 0.539583810843} H1 2613 -1 8 {} O 0.0 {0.409787687644 0.634267873909 0.534301255226} O3 2614 -1 1 {} H 0.0 {0.405742689591 0.626259343548 0.528886961848} H2 2615 -1 8 {} O 0.0 {0.416882476794 0.621673701098 0.560622619322} O4 2616 -1 1 {} H 0.0 {0.414578769365 0.629713810489 0.566988615023} H3 2617 -1 8 {} O 0.0 {0.427124537141 0.616458589315 0.506517543648} O5 2618 -1 1 {} H 0.0 {0.420823248464 0.624439551021 0.50387051511} H4 2619 -1 8 {} O 0.0 {0.455419998096 0.615840258453 0.516620689087} O6 2620 -1 1 {} H 0.0 {0.462243623093 0.623620992872 0.518328336385} H5 2621 -1 8 {} O 0.0 {0.438429029766 0.640185561686 0.521009532225} O7 2622 -1 1 {} H 0.0 {0.44664496272 0.64335192287 0.526722278812} H6 2623 -1 8 {} O 0.0 {0.277868449016 0.490243845978 0.390745442596} O1 2624 -1 14 {} Si 0.0 {0.275505923736 0.504431624394 0.402144792985} Si2 2625 -1 8 {} O 0.0 {0.288241667509 0.503865949216 0.415412377893} O2 2626 -1 1 {} H 0.0 {0.290171899415 0.493864445485 0.41796542241} H1 2627 -1 8 {} O 0.0 {0.277081744887 0.520169540639 0.392755710079} O3 2628 -1 14 {} Si 0.0 {0.612445119295 0.433431603617 0.494835989953} Si1 2629 -1 8 {} O 0.0 {0.597065173828 0.424437961835 0.490348263181} O1 2630 -1 14 {} Si 0.0 {0.597785961249 0.407508187107 0.497486675839} Si2 2631 -1 8 {} O 0.0 {0.609246370711 0.397184575001 0.487483629181} O2 2632 -1 1 {} H 0.0 {0.604451206443 0.394248394317 0.478621406005} H1 2633 -1 8 {} O 0.0 {0.603924365356 0.408416179353 0.514816624973} O3 2634 -1 1 {} H 0.0 {0.595957465866 0.4107628073 0.521224894365} H2 2635 -1 8 {} O 0.0 {0.58100132539 0.399993096882 0.497333700146} O4 2636 -1 1 {} H 0.0 {0.577671606045 0.399100287924 0.487429626619} H3 2637 -1 8 {} O 0.0 {0.626940088232 0.424846371607 0.487471489575} O5 2638 -1 1 {} H 0.0 {0.626591518346 0.425750764056 0.477032420103} H4 2639 -1 8 {} O 0.0 {0.614145927044 0.433642040184 0.513118137507} O6 2640 -1 1 {} H 0.0 {0.606153294037 0.428317954671 0.517396398706} H5 2641 -1 8 {} O 0.0 {0.611650912877 0.450681301685 0.488481996626} O7 2642 -1 1 {} H 0.0 {0.616735165288 0.457067833544 0.495077170109} H6 2643 -1 14 {} Si 0.0 {0.453644722566 0.399369882172 0.266905132689} Si1 2644 -1 8 {} O 0.0 {0.447064369629 0.384690403349 0.275777966941} O1 2645 -1 8 {} O 0.0 {0.423436908427 0.40307008137 0.274692778851} O2 2646 -1 1 {} H 0.0 {0.430839828513 0.408699394216 0.269846341994} H1 2647 -1 8 {} O 0.0 {0.42184304037 0.377558157473 0.290684550719} O4 2648 -1 8 {} O 0.0 {0.452733386552 0.414088512801 0.277896913045} O6 2649 -1 1 {} H 0.0 {0.443123928846 0.418294674664 0.277284860623} H5 2650 -1 14 {} Si 0.0 {0.413538049892 0.474993422536 0.442872931692} Si1 2651 -1 8 {} O 0.0 {0.401757324712 0.488690815403 0.446699406692} O1 2652 -1 14 {} Si 0.0 {0.39800799975 0.498517581914 0.431497410635} Si2 2653 -1 8 {} O 0.0 {0.393436794528 0.515654747346 0.436370507321} O2 2654 -1 1 {} H 0.0 {0.385548969368 0.519010818787 0.430320170182} H1 2655 -1 8 {} O 0.0 {0.412740102318 0.499048545143 0.420522815721} O3 2656 -1 1 {} H 0.0 {0.420982630848 0.495009056311 0.42554076503} H2 2657 -1 8 {} O 0.0 {0.383963369025 0.490848345558 0.422434467642} O4 2658 -1 1 {} H 0.0 {0.380788325483 0.497324809393 0.414802521112} H3 2659 -1 8 {} O 0.0 {0.412934356391 0.462513041987 0.456383906634} O5 2660 -1 1 {} H 0.0 {0.410033538921 0.467184709565 0.465324141025} H4 2661 -1 8 {} O 0.0 {0.430602532272 0.481660944128 0.441448547879} O6 2662 -1 1 {} H 0.0 {0.43670596125 0.474573614285 0.436636276402} H5 2663 -1 8 {} O 0.0 {0.408895660419 0.467019113705 0.427091162157} O7 2664 -1 1 {} H 0.0 {0.416787350079 0.46796103994 0.420245411424} H6 2665 -1 1 {} H 0.0 {0.635406329931 0.604707513713 0.323173736309} H2 2666 -1 14 {} Si 0.0 {0.481164878189 0.703612495351 0.480152970928} Si1 2667 -1 8 {} O 0.0 {0.468928499239 0.71359921349 0.489478515862} O1 2668 -1 14 {} Si 0.0 {0.468369608547 0.70753047674 0.506790989233} Si2 2669 -1 8 {} O 0.0 {0.468794564614 0.721830705028 0.518338720686} O2 2670 -1 1 {} H 0.0 {0.477603335936 0.727327706795 0.516757032361} H1 2671 -1 8 {} O 0.0 {0.452919832274 0.697910043821 0.509400211997} O3 2672 -1 1 {} H 0.0 {0.450983523879 0.692054144192 0.500895940571} H2 2673 -1 8 {} O 0.0 {0.482925914239 0.69669231743 0.509878584223} O4 2674 -1 1 {} H 0.0 {0.489803975962 0.70174472801 0.515987923028} H3 2675 -1 8 {} O 0.0 {0.481805214874 0.686661053983 0.487277170585} O5 2676 -1 1 {} H 0.0 {0.472400610398 0.684211713619 0.491284824687} H4 2677 -1 8 {} O 0.0 {0.497746110409 0.711466159796 0.481482309139} O6 2678 -1 1 {} H 0.0 {0.498605273569 0.719029393741 0.474253334156} H5 2679 -1 8 {} O 0.0 {0.476187646722 0.702666405402 0.46248144414} O7 2680 -1 1 {} H 0.0 {0.481244152494 0.710079876156 0.457040786287} H6 2681 -1 14 {} Si 0.0 {0.552841856517 0.311705388797 0.550145617326} Si1 2682 -1 8 {} O 0.0 {0.540329173129 0.324889438826 0.553246370084} O1 2683 -1 14 {} Si 0.0 {0.534581614928 0.331692798044 0.537119443133} Si2 2684 -1 8 {} O 0.0 {0.537112227713 0.349933161605 0.53684345487} O2 2685 -1 1 {} H 0.0 {0.532821495351 0.354188759744 0.545425532386} H1 2686 -1 8 {} O 0.0 {0.544229708074 0.323980515756 0.523499993511} O3 2687 -1 1 {} H 0.0 {0.53883039617 0.324727269112 0.514535921681} H2 2688 -1 8 {} O 0.0 {0.516732026864 0.327916829166 0.534867256577} O4 2689 -1 1 {} H 0.0 {0.510990796057 0.335761073624 0.538812025208} H3 2690 -1 8 {} O 0.0 {0.550796467999 0.30521994458 0.533039939676} O5 2691 -1 1 {} H 0.0 {0.540577661505 0.304550576501 0.530758686614} H4 2692 -1 8 {} O 0.0 {0.550490638165 0.298063826027 0.562216404335} O6 2693 -1 1 {} H 0.0 {0.553724401557 0.301215721962 0.571691711001} H5 2694 -1 8 {} O 0.0 {0.56975991337 0.318661226368 0.552042785622} O7 2695 -1 1 {} H 0.0 {0.572024005795 0.319613947858 0.562247534303} H6 2696 -1 14 {} Si 0.0 {0.430034551756 0.632553647149 0.319042427133} Si1 2697 -1 8 {} O 0.0 {0.423934269893 0.615921911544 0.314174320316} O1 2698 -1 14 {} Si 0.0 {0.437458700835 0.607002293327 0.305557620444} Si2 2699 -1 8 {} O 0.0 {0.430430015088 0.596126111147 0.292488992704} O2 2700 -1 1 {} H 0.0 {0.419967461204 0.596755148215 0.29268214774} H1 2701 -1 8 {} O 0.0 {0.448843674139 0.619243295147 0.297858420926} O3 2702 -1 8 {} O 0.0 {0.446686971741 0.596799813419 0.317737142113} O4 2703 -1 1 {} H 0.0 {0.443549876881 0.599249992637 0.327426155216} H3 2704 -1 8 {} O 0.0 {0.416301490526 0.642255342372 0.326485156906} O5 2705 -1 1 {} H 0.0 {0.418954428826 0.645142522885 0.33622982866} H4 2706 -1 8 {} O 0.0 {0.443652099623 0.630742026292 0.331299148448} O7 2707 -1 1 {} H 0.0 {0.45284020341 0.630106124351 0.326242358839} H6 2708 -1 14 {} Si 0.0 {0.451440095688 0.325156877388 0.558924831875} Si1 2709 -1 8 {} O 0.0 {0.445574727103 0.342546610981 0.560442212869} O1 2710 -1 14 {} Si 0.0 {0.451675513523 0.352376837793 0.546121034543} Si2 2711 -1 8 {} O 0.0 {0.438920948025 0.352461889677 0.532856954181} O2 2712 -1 1 {} H 0.0 {0.437649544865 0.342714015257 0.529175319657} H1 2713 -1 8 {} O 0.0 {0.455017829422 0.369656348081 0.551505609845} O3 2714 -1 1 {} H 0.0 {0.45822402464 0.369640185482 0.561502850395} H2 2715 -1 8 {} O 0.0 {0.46718083213 0.344856422652 0.539675100373} O4 2716 -1 1 {} H 0.0 {0.46482800494 0.337908961446 0.532163448343} H3 2717 -1 8 {} O 0.0 {0.465379764836 0.322346050339 0.570604285471} O5 2718 -1 1 {} H 0.0 {0.46160912999 0.321313897161 0.580349402384} H4 2719 -1 8 {} O 0.0 {0.457164359919 0.322075670943 0.541707109574} O6 2720 -1 1 {} H 0.0 {0.448855056567 0.321518140548 0.53531519382} H5 2721 -1 8 {} O 0.0 {0.437649686281 0.313653642126 0.562960811037} O7 2722 -1 1 {} H 0.0 {0.433489044714 0.309929423271 0.554067574832} H6 2723 -1 8 {} O 0.0 {0.36038518478 0.5691379395 0.305029484707} O3 2724 -1 1 {} H 0.0 {0.359479914565 0.57707858809 0.31181525063} H2 2725 -1 14 {} Si 0.0 {0.542013070828 0.60874060357 0.390075249611} Si1 2726 -1 8 {} O 0.0 {0.528782652562 0.606315074559 0.37750517253} O1 2727 -1 14 {} Si 0.0 {0.531261221464 0.61798536093 0.363426350856} Si2 2728 -1 8 {} O 0.0 {0.525506387317 0.634861167209 0.368144596898} O2 2729 -1 1 {} H 0.0 {0.515009184677 0.635182317239 0.367887802023} H1 2730 -1 8 {} O 0.0 {0.549109128171 0.618674976476 0.359036793646} O3 2731 -1 1 {} H 0.0 {0.55374127365 0.609704622313 0.361864947254} H2 2732 -1 8 {} O 0.0 {0.521615228211 0.612084967518 0.348913668072} O4 2733 -1 1 {} H 0.0 {0.513064710299 0.606993037739 0.352258093906} H3 2734 -1 8 {} O 0.0 {0.556767060521 0.616305903881 0.382133255363} O5 2735 -1 1 {} H 0.0 {0.553976784469 0.62526479833 0.377440410248} H4 2736 -1 8 {} O 0.0 {0.546650656672 0.592481069893 0.397397110538} O6 2737 -1 1 {} H 0.0 {0.538419139964 0.588493418985 0.40256499193} H5 2738 -1 8 {} O 0.0 {0.535858082177 0.619861130444 0.403305651782} O7 2739 -1 1 {} H 0.0 {0.543952652372 0.623197978222 0.409073697657} H6 2740 -1 8 {} O 0.0 {0.43028141648 0.657809510799 0.333465550148} O5 2741 -1 1 {} H 0.0 {0.434282410936 0.656791358031 0.323823019781} H4 2742 -1 8 {} O 0.0 {0.42744078089 0.677225501949 0.35620590489} O6 2743 -1 1 {} H 0.0 {0.435915984087 0.68180235017 0.36042726355} H5 2744 -1 1 {} H 0.0 {0.453712971969 0.677881541945 0.336950702761} H6 2745 -1 14 {} Si 0.0 {0.565392929568 0.468822264727 0.341363327249} Si1 2746 -1 8 {} O 0.0 {0.578448053556 0.478355398135 0.35012209449} O1 2747 -1 14 {} Si 0.0 {0.571186658487 0.486167564127 0.365096992405} Si2 2748 -1 8 {} O 0.0 {0.562533757049 0.501675983079 0.360316150797} O2 2749 -1 1 {} H 0.0 {0.569616878571 0.509196378962 0.358469370798} H1 2750 -1 8 {} O 0.0 {0.559167581322 0.47457676457 0.372834099352} O3 2751 -1 1 {} H 0.0 {0.555049015283 0.47901438863 0.381391431888} H2 2752 -1 8 {} O 0.0 {0.584585167882 0.490055697776 0.377096282454} O4 2753 -1 1 {} H 0.0 {0.591282761911 0.496880204747 0.372759147053} H3 2754 -1 8 {} O 0.0 {0.572404369739 0.452968446842 0.33532830592} O5 2755 -1 1 {} H 0.0 {0.570775093765 0.445480756099 0.342480855785} H4 2756 -1 8 {} O 0.0 {0.559159617606 0.478631436729 0.327093011991} O6 2757 -1 1 {} H 0.0 {0.551052643982 0.484536000843 0.330204605831} H5 2758 -1 8 {} O 0.0 {0.551545461959 0.465324248651 0.352920708644} O7 2759 -1 1 {} H 0.0 {0.546788147344 0.474311009405 0.355472695686} H6 2760 -1 14 {} Si 0.0 {0.657089921963 0.409196639098 0.460057097619} Si1 2761 -1 8 {} O 0.0 {0.641374661739 0.41560846688 0.467150806394} O1 2762 -1 14 {} Si 0.0 {0.627580801234 0.404626505353 0.461961843239} Si2 2763 -1 8 {} O 0.0 {0.611454178691 0.412745736834 0.465593332129} O2 2764 -1 1 {} H 0.0 {0.612436788887 0.418858295163 0.474062091875} H1 2765 -1 8 {} O 0.0 {0.628871327001 0.401374404492 0.443911997629} O3 2766 -1 1 {} H 0.0 {0.635802387412 0.393663767638 0.442254196107} H2 2767 -1 8 {} O 0.0 {0.628690262312 0.388711898048 0.471124188009} O4 2768 -1 1 {} H 0.0 {0.621043219169 0.388261571456 0.478279853393} H3 2769 -1 8 {} O 0.0 {0.655902059892 0.409079335165 0.441709239263} O5 2770 -1 1 {} H 0.0 {0.660438977926 0.417716046679 0.437866595161} H4 2771 -1 8 {} O 0.0 {0.659971352509 0.392042083686 0.466060509393} O6 2772 -1 1 {} H 0.0 {0.670284003622 0.390398095712 0.467116575509} H5 2773 -1 8 {} O 0.0 {0.671069228935 0.419987741505 0.46526244309} O7 2774 -1 1 {} H 0.0 {0.667278165871 0.428801090378 0.469530587613} H6 2775 -1 8 {} O 0.0 {0.69487483175 0.359742610083 0.492571349469} O7 2776 -1 1 {} H 0.0 {0.694476644925 0.369950022807 0.490207382454} H6 2777 -1 8 {} O 0.0 {0.578191684607 0.680469906157 0.610353361748} O2 2778 -1 1 {} H 0.0 {0.58597401665 0.682671218648 0.603666847506} H1 2779 -1 8 {} O 0.0 {0.554056019635 0.692785874995 0.62333687075} O3 2780 -1 1 {} H 0.0 {0.546909048646 0.697828223987 0.617518690351} H2 2781 -1 1 {} H 0.0 {0.571084925084 0.703564896586 0.593820004341} H3 2782 -1 8 {} O 0.0 {0.306969073026 0.441146178058 0.348464009145} O1 2783 -1 14 {} Si 0.0 {0.32510931399 0.439618805179 0.345015505853} Si2 2784 -1 8 {} O 0.0 {0.334652096802 0.445675019968 0.359509223261} O2 2785 -1 1 {} H 0.0 {0.334707039758 0.456171137209 0.359496817719} H1 2786 -1 8 {} O 0.0 {0.329479034654 0.422082500544 0.341707379155} O3 2787 -1 1 {} H 0.0 {0.320769522107 0.416635887849 0.339871713038} H2 2788 -1 8 {} O 0.0 {0.329438771033 0.449904242092 0.330392348846} O4 2789 -1 1 {} H 0.0 {0.330314973495 0.459934875565 0.333318976331} H3 2790 -1 8 {} O 0.0 {0.302030662554 0.416928431656 0.365798586106} O6 2791 -1 1 {} H 0.0 {0.31017168785 0.421734475546 0.37032938913} H5 2792 -1 14 {} Si 0.0 {0.646711860929 0.407438817937 0.53246241312} Si1 2793 -1 8 {} O 0.0 {0.638551196846 0.423870309515 0.530608631662} O1 2794 -1 14 {} Si 0.0 {0.620539873991 0.421565718139 0.527565322097} Si2 2795 -1 8 {} O 0.0 {0.611720932202 0.437480813643 0.530458801465} O2 2796 -1 1 {} H 0.0 {0.601739225911 0.435512701709 0.533078126635} H1 2797 -1 8 {} O 0.0 {0.618094108923 0.416270634021 0.510159756749} O3 2798 -1 1 {} H 0.0 {0.625586198787 0.420531175896 0.504177644357} H2 2799 -1 8 {} O 0.0 {0.613814837382 0.408729388152 0.538956980863} O4 2800 -1 1 {} H 0.0 {0.607030829096 0.413190093991 0.545629746204} H3 2801 -1 8 {} O 0.0 {0.636532942199 0.394469923177 0.524188868782} O5 2802 -1 1 {} H 0.0 {0.634889768588 0.397156988065 0.514198344178} H4 2803 -1 8 {} O 0.0 {0.648425818212 0.403402326506 0.550384008252} O6 2804 -1 1 {} H 0.0 {0.658615616927 0.402530064964 0.552827036714} H5 2805 -1 8 {} O 0.0 {0.663361523307 0.407987083066 0.524709432998} O7 2806 -1 1 {} H 0.0 {0.670599091833 0.409654585516 0.532119986498} H6 2807 -1 14 {} Si 0.0 {0.577305603083 0.43387419967 0.380476646236} Si1 2808 -1 8 {} O 0.0 {0.588631485935 0.442870192156 0.369150761116} O1 2809 -1 14 {} Si 0.0 {0.585575836572 0.460969705618 0.370218849432} Si2 2810 -1 8 {} O 0.0 {0.598625374841 0.469879083609 0.360801151995} O2 2811 -1 1 {} H 0.0 {0.605446976431 0.462920641186 0.356875768405} H1 2812 -1 8 {} O 0.0 {0.569118865915 0.464851931788 0.362999923541} O3 2813 -1 1 {} H 0.0 {0.562289990076 0.457336852244 0.365644366551} H2 2814 -1 8 {} O 0.0 {0.586014633631 0.466293434116 0.387830386233} O4 2815 -1 1 {} H 0.0 {0.584156572719 0.458025917095 0.394022393896} H3 2816 -1 8 {} O 0.0 {0.565291007926 0.44567530474 0.387864546712} O5 2817 -1 1 {} H 0.0 {0.55800596414 0.44815734899 0.380727683925} H4 2818 -1 8 {} O 0.0 {0.587145791288 0.425928715524 0.393846761389} O6 2819 -1 1 {} H 0.0 {0.582403152339 0.417078942815 0.396887096918} H5 2820 -1 8 {} O 0.0 {0.56821672058 0.420962695845 0.371000989608} O7 2821 -1 1 {} H 0.0 {0.566284671237 0.412752715371 0.377245880765} H6 2822 -1 14 {} Si 0.0 {0.669925490531 0.534989422243 0.605786438012} Si1 2823 -1 8 {} O 0.0 {0.671992255408 0.548410033195 0.618202902048} O1 2824 -1 14 {} Si 0.0 {0.688558498246 0.556184595098 0.616141206947} Si2 2825 -1 8 {} O 0.0 {0.701348043592 0.543091497384 0.613977436859} O2 2826 -1 1 {} H 0.0 {0.709786785556 0.547184014113 0.609223371624} H1 2827 -1 8 {} O 0.0 {0.688301554901 0.567060249128 0.601322092221} O3 2828 -1 1 {} H 0.0 {0.678563275415 0.56739321985 0.597432313375} H2 2829 -1 8 {} O 0.0 {0.675230953025 0.54106305541 0.589249588352} O5 2830 -1 1 {} H 0.0 {0.685562553426 0.53953469044 0.588125747617} H4 2831 -1 8 {} O 0.0 {0.652238236933 0.530005158301 0.605123359344} O6 2832 -1 1 {} H 0.0 {0.648405484313 0.529486691208 0.614890737948} H5 2833 -1 8 {} O 0.0 {0.680177791304 0.520481386187 0.610573242948} O7 2834 -1 1 {} H 0.0 {0.674303663681 0.511785862269 0.610181812188} H6 2835 -1 14 {} Si 0.0 {0.479527634106 0.465187611016 0.254322271239} Si1 2836 -1 14 {} Si 0.0 {0.506808343163 0.452876485289 0.254115942914} Si2 2837 -1 8 {} O 0.0 {0.512861195572 0.468412841476 0.261827197159} O2 2838 -1 1 {} H 0.0 {0.513971934132 0.475764852314 0.25440300118} H1 2839 -1 8 {} O 0.0 {0.502296264046 0.440797093041 0.267249587007} O3 2840 -1 1 {} H 0.0 {0.495178258755 0.434043691102 0.263484288812} H2 2841 -1 1 {} H 0.0 {0.455937679338 0.469192281089 0.252044359635} H4 2842 -1 8 {} O 0.0 {0.484726535755 0.482561323693 0.257202295469} O6 2843 -1 1 {} H 0.0 {0.492553623364 0.482735899807 0.264174971075} H5 2844 -1 8 {} O 0.0 {0.478109818563 0.456525773428 0.270487221677} O7 2845 -1 1 {} H 0.0 {0.473757204567 0.462978635905 0.277518635872} H6 2846 -1 14 {} Si 0.0 {0.547857504164 0.545744479175 0.678831495944} Si1 2847 -1 8 {} O 0.0 {0.548986384919 0.528889529568 0.686137497559} O1 2848 -1 14 {} Si 0.0 {0.562209949077 0.528531359182 0.698934879669} Si2 2849 -1 8 {} O 0.0 {0.570407502974 0.512054753561 0.69879358484} O2 2850 -1 1 {} H 0.0 {0.569936008319 0.507837110332 0.708399352729} H1 2851 -1 8 {} O 0.0 {0.574638282682 0.541595542551 0.695300046304} O3 2852 -1 1 {} H 0.0 {0.572935483463 0.549866695327 0.701530725539} H2 2853 -1 8 {} O 0.0 {0.554788005137 0.531532185452 0.71551061394} O4 2854 -1 1 {} H 0.0 {0.56195986788 0.529629364327 0.722941433807} H3 2855 -1 8 {} O 0.0 {0.56349440005 0.554888832884 0.682007730965} O5 2856 -1 1 {} H 0.0 {0.570974433815 0.551342726198 0.675556521607} H4 2857 -1 8 {} O 0.0 {0.533783350199 0.5548098883 0.686480646385} O6 2858 -1 1 {} H 0.0 {0.526446736591 0.556644401223 0.679202697308} H5 2859 -1 8 {} O 0.0 {0.545121461378 0.544367102986 0.660680415994} O7 2860 -1 1 {} H 0.0 {0.534949684945 0.542520461451 0.658811861199} H6 2861 -1 14 {} Si 0.0 {0.61148499337 0.607159419924 0.504185953062} Si1 2862 -1 8 {} O 0.0 {0.623219464789 0.601831374992 0.491038312364} O1 2863 -1 14 {} Si 0.0 {0.627207494805 0.616157189619 0.480192875994} Si2 2864 -1 8 {} O 0.0 {0.645241570205 0.619727333464 0.481113408271} O2 2865 -1 1 {} H 0.0 {0.650206312698 0.611526302831 0.485396472998} H1 2866 -1 8 {} O 0.0 {0.622634585593 0.612161171186 0.462822519265} O3 2867 -1 1 {} H 0.0 {0.614358991243 0.605697452775 0.462797271139} H2 2868 -1 8 {} O 0.0 {0.617751338498 0.630914333826 0.485779527371} O4 2869 -1 1 {} H 0.0 {0.624104192638 0.639269836059 0.485955852256} H3 2870 -1 8 {} O 0.0 {0.594485530787 0.608146406404 0.497216180236} O5 2871 -1 1 {} H 0.0 {0.591292401291 0.598543000363 0.494426002101} H4 2872 -1 8 {} O 0.0 {0.616481910233 0.623689205759 0.510546456067} O6 2873 -1 1 {} H 0.0 {0.611681527453 0.625500231385 0.519709578098} H5 2874 -1 8 {} O 0.0 {0.611750712387 0.594950570807 0.51795011946} O7 2875 -1 1 {} H 0.0 {0.617191888116 0.598901791055 0.526011655254} H6 2876 -1 14 {} Si 0.0 {0.365640017759 0.496820879628 0.396694441147} Si1 2877 -1 8 {} O 0.0 {0.383952389296 0.498146781667 0.395632422446} O1 2878 -1 14 {} Si 0.0 {0.388867616463 0.501016944635 0.378122734456} Si2 2879 -1 8 {} O 0.0 {0.40358052025 0.490724516337 0.374173885905} O2 2880 -1 1 {} H 0.0 {0.40331207183 0.481931438696 0.379905386917} H1 2881 -1 8 {} O 0.0 {0.374971586069 0.496367599164 0.36698904368} O3 2882 -1 1 {} H 0.0 {0.368622718758 0.504629010321 0.365693958264} H2 2883 -1 8 {} O 0.0 {0.392991571314 0.518795801842 0.375699479782} O4 2884 -1 1 {} H 0.0 {0.391498083275 0.523987863304 0.384698938197} H3 2885 -1 8 {} O 0.0 {0.35995397264 0.482131601024 0.387198780258} O5 2886 -1 1 {} H 0.0 {0.367560934171 0.474905009156 0.387064444312} H4 2887 -1 8 {} O 0.0 {0.358075667925 0.511951930685 0.389674208392} O6 2888 -1 1 {} H 0.0 {0.35880146821 0.519759043874 0.396663680742} H5 2889 -1 8 {} O 0.0 {0.360593529407 0.495096602099 0.414300852462} O7 2890 -1 1 {} H 0.0 {0.352157761011 0.501095165443 0.416103359942} H6 2891 -1 8 {} O 0.0 {0.614600644425 0.680850583867 0.398193046746} O1 2892 -1 8 {} O 0.0 {0.590043589909 0.693126678314 0.410322214584} O2 2893 -1 1 {} H 0.0 {0.586822852384 0.701038481417 0.416405982546} H1 2894 -1 8 {} O 0.0 {0.640420710761 0.673421759198 0.411641292582} O5 2895 -1 1 {} H 0.0 {0.636258449954 0.663828173894 0.412135845099} H4 2896 -1 8 {} O 0.0 {0.724752042616 0.408985583755 0.493350540986} O3 2897 -1 1 {} H 0.0 {0.72143458229 0.408808341135 0.503325142728} H2 2898 -1 8 {} O 0.0 {0.73880267571 0.435480830297 0.49481978096} O4 2899 -1 1 {} H 0.0 {0.739488415256 0.440296689056 0.485517765121} H3 2900 -1 14 {} Si 0.0 {0.601368978455 0.39927165614 0.309696317213} Si1 2901 -1 8 {} O 0.0 {0.60667309357 0.384904549033 0.319839540025} O1 2902 -1 14 {} Si 0.0 {0.592277801772 0.378671405353 0.329436941219} Si2 2903 -1 8 {} O 0.0 {0.584927913106 0.392501185724 0.339105488202} O2 2904 -1 1 {} H 0.0 {0.591352107637 0.395038976252 0.347011421943} H1 2905 -1 8 {} O 0.0 {0.57966054742 0.371910295403 0.317875236179} O3 2906 -1 1 {} H 0.0 {0.580963274564 0.361535254228 0.316962581827} H2 2907 -1 8 {} O 0.0 {0.597829899005 0.365401613792 0.340910209213} O4 2908 -1 1 {} H 0.0 {0.604849367971 0.36933387803 0.34765275041} H3 2909 -1 8 {} O 0.0 {0.600145246513 0.414192677645 0.320381750387} O5 2910 -1 1 {} H 0.0 {0.609454760281 0.416034388979 0.324871278779} H4 2911 -1 8 {} O 0.0 {0.584969150258 0.395677959063 0.302248468034} O6 2912 -1 1 {} H 0.0 {0.583615254673 0.38527975006 0.301707462286} H5 2913 -1 8 {} O 0.0 {0.613654639034 0.402269732649 0.296336778531} O7 2914 -1 8 {} O 0.0 {0.402149409821 0.28676798465 0.398710075015} O2 2915 -1 1 {} H 0.0 {0.410563517805 0.292937994707 0.399780495948} H1 2916 -1 8 {} O 0.0 {0.423979213629 0.267897448712 0.407267133062} O4 2917 -1 1 {} H 0.0 {0.428441860375 0.269255250654 0.397870265485} H3 2918 -1 1 {} H 0.0 {0.581897071629 0.405808441256 0.711870453225} H4 2919 -1 14 {} Si 0.0 {0.393742179688 0.470831101255 0.421397268227} Si1 2920 -1 8 {} O 0.0 {0.399046739863 0.453632876609 0.426203528985} O1 2921 -1 14 {} Si 0.0 {0.403780287564 0.443660082573 0.411244990048} Si2 2922 -1 8 {} O 0.0 {0.4216145545 0.446342260298 0.40731820285} O2 2923 -1 1 {} H 0.0 {0.422455467753 0.453117910356 0.399365916136} H1 2924 -1 8 {} O 0.0 {0.400868804495 0.425814617645 0.414714258224} O3 2925 -1 1 {} H 0.0 {0.402928374905 0.423823294415 0.424821598404} H2 2926 -1 8 {} O 0.0 {0.393669536807 0.448827414114 0.396846349137} O4 2927 -1 1 {} H 0.0 {0.399828366066 0.453600268895 0.389811757841} H3 2928 -1 8 {} O 0.0 {0.408421658083 0.480873847682 0.416986552917} O5 2929 -1 1 {} H 0.0 {0.413940462738 0.482841180748 0.425660812911} H4 2930 -1 8 {} O 0.0 {0.385194286139 0.478660298372 0.435750660072} O6 2931 -1 1 {} H 0.0 {0.37556968484 0.4817327515 0.432867946702} H5 2932 -1 8 {} O 0.0 {0.382244258347 0.470125098922 0.407015958556} O7 2933 -1 1 {} H 0.0 {0.372827596772 0.473774521677 0.40988249486} H6 2934 -1 14 {} Si 0.0 {0.583094556096 0.482489035047 0.722048491783} Si1 2935 -1 8 {} O 0.0 {0.591026639959 0.465938769506 0.722042903464} O1 2936 -1 8 {} O 0.0 {0.615509780861 0.479912194327 0.712032677042} O3 2937 -1 1 {} H 0.0 {0.608457621267 0.481051427218 0.704315859947} H2 2938 -1 8 {} O 0.0 {0.595289810154 0.495124417515 0.716517357298} O5 2939 -1 1 {} H 0.0 {0.591025832857 0.501015924218 0.70894548452} H4 2940 -1 8 {} O 0.0 {0.568674058871 0.482425663434 0.710619333306} O7 2941 -1 1 {} H 0.0 {0.572085632286 0.482623924246 0.700691188134} H6 2942 -1 1 {} H 0.0 {0.463711017069 0.394760190109 0.717189234937} H6 2943 -1 14 {} Si 0.0 {0.487441577078 0.54466750696 0.418679504043} Si1 2944 -1 8 {} O 0.0 {0.474118021833 0.557245589659 0.417175511846} O1 2945 -1 14 {} Si 0.0 {0.480175970043 0.571353290463 0.407028666532} Si2 2946 -1 8 {} O 0.0 {0.484544507496 0.565358388991 0.390192422382} O2 2947 -1 1 {} H 0.0 {0.484585350429 0.554862192087 0.390132342942} H1 2948 -1 8 {} O 0.0 {0.467002520256 0.584118591311 0.40576306018} O3 2949 -1 1 {} H 0.0 {0.467340235962 0.590326306935 0.414224351084} H2 2950 -1 8 {} O 0.0 {0.495066447216 0.57868251899 0.414970388521} O4 2951 -1 1 {} H 0.0 {0.50356475511 0.573167040576 0.412210798447} H3 2952 -1 8 {} O 0.0 {0.496634892805 0.547315069775 0.434383581542} O5 2953 -1 1 {} H 0.0 {0.490850464004 0.553243233433 0.440840193157} H4 2954 -1 8 {} O 0.0 {0.498995677313 0.546290808855 0.404475604151} O6 2955 -1 1 {} H 0.0 {0.494609088128 0.542050322468 0.395925222148} H5 2956 -1 8 {} O 0.0 {0.480076258457 0.527824999424 0.418655592566} O7 2957 -1 1 {} H 0.0 {0.486799083743 0.521082950702 0.414225174317} H6 2958 -1 14 {} Si 0.0 {0.396453584896 0.36492835231 0.577897215103} Si1 2959 -1 8 {} O 0.0 {0.387498446646 0.356894051833 0.563992915776} O1 2960 -1 14 {} Si 0.0 {0.399442342323 0.347328799747 0.553799550149} Si2 2961 -1 8 {} O 0.0 {0.411820207027 0.339300691253 0.564794611267} O2 2962 -1 1 {} H 0.0 {0.420723403337 0.344865461488 0.564671760503} H1 2963 -1 8 {} O 0.0 {0.390422356273 0.334435803638 0.544270171046} O3 2964 -1 1 {} H 0.0 {0.395066101038 0.333099974681 0.534951424403} H2 2965 -1 8 {} O 0.0 {0.408040317241 0.358690885352 0.542154858048} O4 2966 -1 1 {} H 0.0 {0.41607500789 0.363317176616 0.547087876252} H3 2967 -1 8 {} O 0.0 {0.384357579749 0.373200430194 0.589009635402} O5 2968 -1 1 {} H 0.0 {0.376137761173 0.366852553406 0.590554069692} H4 2969 -1 8 {} O 0.0 {0.408196860032 0.377415115978 0.5712133157} O6 2970 -1 1 {} H 0.0 {0.407637762946 0.377464908616 0.560726304741} H5 2971 -1 8 {} O 0.0 {0.405766839641 0.352190268627 0.587361608334} O7 2972 -1 1 {} H 0.0 {0.415786762162 0.355179450662 0.588304714755} H6 2973 -1 14 {} Si 0.0 {0.564659834591 0.37877345496 0.348973452177} Si1 2974 -1 8 {} O 0.0 {0.56237890956 0.392080632983 0.336506641794} O1 2975 -1 14 {} Si 0.0 {0.550305542829 0.386360969167 0.323892804606} Si2 2976 -1 8 {} O 0.0 {0.552605583169 0.395870619872 0.308294405313} O2 2977 -1 1 {} H 0.0 {0.543454673776 0.39646405952 0.303195087404} H1 2978 -1 8 {} O 0.0 {0.553011850953 0.368486247151 0.32057170537} O3 2979 -1 1 {} H 0.0 {0.546852655271 0.362805700819 0.326876019517} H2 2980 -1 8 {} O 0.0 {0.533225837518 0.388903916584 0.330252079071} O4 2981 -1 1 {} H 0.0 {0.527774383866 0.394684677274 0.323409619633} H3 2982 -1 8 {} O 0.0 {0.582052300365 0.372841403293 0.348446476023} O5 2983 -1 1 {} H 0.0 {0.588359990715 0.380156421924 0.352552092567} H4 2984 -1 8 {} O 0.0 {0.553313547026 0.364817070624 0.345111061206} O6 2985 -1 1 {} H 0.0 {0.544912581183 0.365308657524 0.351388582134} H5 2986 -1 8 {} O 0.0 {0.560846239975 0.385297682294 0.365758403909} O7 2987 -1 1 {} H 0.0 {0.555037037623 0.378274058098 0.370992742865} H6 2988 -1 14 {} Si 0.0 {0.610604350111 0.615819677103 0.378925803456} Si1 2989 -1 8 {} O 0.0 {0.617225596819 0.599795104759 0.385320834954} O1 2990 -1 14 {} Si 0.0 {0.629549560278 0.603028375843 0.398582479496} Si2 2991 -1 8 {} O 0.0 {0.621122582578 0.610597326476 0.413095685471} O2 2992 -1 1 {} H 0.0 {0.611609810574 0.606293304446 0.414255378135} H1 2993 -1 8 {} O 0.0 {0.637444266617 0.587189378513 0.403624232178} O3 2994 -1 1 {} H 0.0 {0.633179739892 0.579278084768 0.398196294696} H2 2995 -1 8 {} O 0.0 {0.642413110005 0.614507972172 0.392234472523} O4 2996 -1 1 {} H 0.0 {0.643288738345 0.613338431268 0.381834688988} H3 2997 -1 8 {} O 0.0 {0.597118162496 0.612518193585 0.366835016169} O5 2998 -1 1 {} H 0.0 {0.589891450988 0.620111325942 0.367507243319} H4 2999 -1 8 {} O 0.0 {0.624100186907 0.625197260712 0.370632413408} O6 3000 -1 1 {} H 0.0 {0.619989305144 0.633218615033 0.365267537305} H5 3001 -1 8 {} O 0.0 {0.603915604012 0.625706189063 0.392907265984} O7 3002 -1 1 {} H 0.0 {0.596982073215 0.632681569684 0.389240628544} H6 3003 -1 8 {} O 0.0 {0.527369099964 0.246153345312 0.473862969191} O4 3004 -1 1 {} H 0.0 {0.559398193695 0.301823268706 0.340444930037} H2 3005 -1 8 {} O 0.0 {0.54923891345 0.323994129138 0.32282486877} O4 3006 -1 1 {} H 0.0 {0.54325176996 0.328218565283 0.315308769095} H3 3007 -1 8 {} O 0.0 {0.562440960076 0.336994670103 0.314053166368} O5 3008 -1 1 {} H 0.0 {0.562800357238 0.339352946267 0.324277394017} H4 3009 -1 14 {} Si 0.0 {0.571951216451 0.537515362253 0.389758236239} Si1 3010 -1 8 {} O 0.0 {0.562329634711 0.54276518285 0.404558187069} O1 3011 -1 14 {} Si 0.0 {0.558938755685 0.560845531402 0.403638187328} Si2 3012 -1 8 {} O 0.0 {0.540758882259 0.563681699102 0.403486494477} O2 3013 -1 1 {} H 0.0 {0.536845622247 0.560753572843 0.394198046756} H1 3014 -1 8 {} O 0.0 {0.566318408931 0.569235263717 0.41825822534} O3 3015 -1 1 {} H 0.0 {0.573701691293 0.563073658898 0.422462196605} H2 3016 -1 8 {} O 0.0 {0.566335294502 0.567710895151 0.388259077541} O4 3017 -1 1 {} H 0.0 {0.575116395569 0.572945913791 0.390650372878} H3 3018 -1 8 {} O 0.0 {0.587901595193 0.54667902577 0.389228191397} O5 3019 -1 1 {} H 0.0 {0.593059172513 0.544197143619 0.38042283401} H4 3020 -1 8 {} O 0.0 {0.5622817396 0.541158605253 0.374530891868} O6 3021 -1 1 {} H 0.0 {0.557019236958 0.532553870638 0.371603753621} H5 3022 -1 8 {} O 0.0 {0.575300618532 0.51944573927 0.390707317166} O7 3023 -1 1 {} H 0.0 {0.583035848184 0.516971008858 0.384048914744} H6 3024 -1 14 {} Si 0.0 {0.32999917841 0.355684602289 0.510636275166} Si1 3025 -1 8 {} O 0.0 {0.319980012646 0.34777652017 0.524024422461} O1 3026 -1 14 {} Si 0.0 {0.330355832191 0.344565174454 0.539070050304} Si2 3027 -1 8 {} O 0.0 {0.331143593485 0.359636934382 0.549468672031} O2 3028 -1 1 {} H 0.0 {0.326646251667 0.357685020561 0.558766017473} H1 3029 -1 8 {} O 0.0 {0.322762465041 0.330905593168 0.548859534397} O3 3030 -1 1 {} H 0.0 {0.329742517688 0.323151640329 0.550074112827} H2 3031 -1 8 {} O 0.0 {0.347401415083 0.33975246965 0.534035126526} O4 3032 -1 1 {} H 0.0 {0.354142631343 0.347230500264 0.536990846127} H3 3033 -1 8 {} O 0.0 {0.327843206586 0.373914404127 0.511248974962} O5 3034 -1 1 {} H 0.0 {0.33682285767 0.378367537875 0.514329318433} H4 3035 -1 8 {} O 0.0 {0.32425027879 0.34945452868 0.494302074762} O6 3036 -1 1 {} H 0.0 {0.332078267446 0.344329817787 0.489584342597} H5 3037 -1 8 {} O 0.0 {0.347771381874 0.351602213846 0.512872344982} O7 3038 -1 1 {} H 0.0 {0.353643599478 0.359105706402 0.508488742327} H6 3039 -1 14 {} Si 0.0 {0.624934507147 0.592817071845 0.356553857331} Si1 3040 -1 8 {} O 0.0 {0.60793351551 0.58911551438 0.350360153344} O1 3041 -1 14 {} Si 0.0 {0.595227988107 0.592576351612 0.363349048081} Si2 3042 -1 8 {} O 0.0 {0.603068492667 0.600164236994 0.378075899084} O2 3043 -1 1 {} H 0.0 {0.596246219493 0.600075390278 0.386092493637} H1 3044 -1 8 {} O 0.0 {0.582562530111 0.604101532158 0.356583745414} O3 3045 -1 1 {} H 0.0 {0.587124795314 0.610778457279 0.349886776288} H2 3046 -1 8 {} O 0.0 {0.587158890235 0.576857545132 0.368336317137} O4 3047 -1 1 {} H 0.0 {0.589187621105 0.574969745392 0.378472806944} H3 3048 -1 8 {} O 0.0 {0.625580062457 0.609979108442 0.363080336314} O5 3049 -1 1 {} H 0.0 {0.619935268766 0.616276873088 0.356868266941} H4 3050 -1 8 {} O 0.0 {0.636907037365 0.59112670687 0.34266092059} O6 3051 -1 1 {} H 0.0 {0.646485190704 0.593915630988 0.345921832213} H5 3052 -1 8 {} O 0.0 {0.629430265672 0.580996366633 0.36992314663} O7 3053 -1 1 {} H 0.0 {0.639790382001 0.579190644459 0.369637754193} H6 3054 -1 14 {} Si 0.0 {0.422901355312 0.471821102274 0.530125045668} Si1 3055 -1 8 {} O 0.0 {0.432623487793 0.487349421827 0.528939665518} O1 3056 -1 14 {} Si 0.0 {0.426790074654 0.49703654697 0.51448457956} Si2 3057 -1 8 {} O 0.0 {0.441286078712 0.502230797758 0.50444030107} O2 3058 -1 1 {} H 0.0 {0.448623283424 0.494737436447 0.504775844664} H1 3059 -1 8 {} O 0.0 {0.415552171056 0.486626122132 0.504256756288} O3 3060 -1 1 {} H 0.0 {0.40796697618 0.492635880446 0.500166776821} H2 3061 -1 8 {} O 0.0 {0.417716080546 0.511919114228 0.520340604822} O4 3062 -1 1 {} H 0.0 {0.414823368928 0.510519949576 0.530324336025} H3 3063 -1 8 {} O 0.0 {0.425864165323 0.464018456903 0.546492978428} O5 3064 -1 1 {} H 0.0 {0.423221092743 0.470766598081 0.554080151445} H4 3065 -1 8 {} O 0.0 {0.428098480025 0.460280250771 0.516766637432} O6 3066 -1 1 {} H 0.0 {0.419591761123 0.456578894437 0.511848123749} H5 3067 -1 8 {} O 0.0 {0.405004315527 0.475675825608 0.528307701755} O7 3068 -1 1 {} H 0.0 {0.399814978285 0.46695790458 0.52562964046} H6 3069 -1 8 {} O 0.0 {0.277907047215 0.376822291615 0.526445173872} O5 3070 -1 1 {} H 0.0 {0.28048726996 0.386383392923 0.529930457898} H4 3071 -1 14 {} Si 0.0 {0.656276858523 0.50582652455 0.351712577734} Si1 3072 -1 8 {} O 0.0 {0.645034828087 0.491740226853 0.347313073546} O1 3073 -1 14 {} Si 0.0 {0.63489014397 0.495557736982 0.332353899856} Si2 3074 -1 8 {} O 0.0 {0.644388274865 0.490967326984 0.317181093162} O2 3075 -1 1 {} H 0.0 {0.65130279399 0.498528926399 0.314915858331} H1 3076 -1 8 {} O 0.0 {0.619365732142 0.48567759761 0.332948692661} O3 3077 -1 1 {} H 0.0 {0.618689459313 0.480783485822 0.342218193013} H2 3078 -1 8 {} O 0.0 {0.630616781354 0.513550730521 0.332037379038} O4 3079 -1 1 {} H 0.0 {0.629291169547 0.516730927548 0.322133029152} H3 3080 -1 8 {} O 0.0 {0.653957065121 0.520010037203 0.340175993446} O5 3081 -1 1 {} H 0.0 {0.658907389686 0.528452760208 0.34397728618} H4 3082 -1 8 {} O 0.0 {0.673737538036 0.500130324379 0.350830094024} O6 3083 -1 1 {} H 0.0 {0.678685244488 0.502674583828 0.359725117733} H5 3084 -1 8 {} O 0.0 {0.652561170234 0.511320881679 0.368862424088} O7 3085 -1 1 {} H 0.0 {0.660060137247 0.517891082965 0.37211527515} H6 3086 -1 14 {} Si 0.0 {0.419332369355 0.598465848428 0.6859173137} Si1 3087 -1 8 {} O 0.0 {0.430194900752 0.606703472152 0.673564119751} O1 3088 -1 14 {} Si 0.0 {0.423496253184 0.603700736887 0.656679530314} Si2 3089 -1 8 {} O 0.0 {0.41756388917 0.586322459619 0.655453631187} O2 3090 -1 1 {} H 0.0 {0.425789251623 0.579799869731 0.655707093658} H1 3091 -1 8 {} O 0.0 {0.409481047471 0.615190160093 0.653540123737} O3 3092 -1 1 {} H 0.0 {0.412952901831 0.623553976328 0.648233527112} H2 3093 -1 8 {} O 0.0 {0.436709512863 0.6065655853 0.644183927091} O4 3094 -1 1 {} H 0.0 {0.44207813742 0.597663446234 0.642671182332} H3 3095 -1 8 {} O 0.0 {0.403415170965 0.593901219771 0.677924274263} O5 3096 -1 1 {} H 0.0 {0.404120898217 0.584169435744 0.674067584541} H4 3097 -1 8 {} O 0.0 {0.427613550088 0.583300432481 0.69221971836} O7 3098 -1 1 {} H 0.0 {0.435491798344 0.58602994449 0.698603859763} H6 3099 -1 14 {} Si 0.0 {0.48956527696 0.514378172777 0.606102440989} Si1 3100 -1 8 {} O 0.0 {0.506797772231 0.512439329908 0.612329630089} O1 3101 -1 14 {} Si 0.0 {0.515547811182 0.52862812322 0.61140298587} Si2 3102 -1 8 {} O 0.0 {0.513052904265 0.537889556758 0.627108599533} O2 3103 -1 1 {} H 0.0 {0.509157226577 0.547406488466 0.624971853506} H1 3104 -1 8 {} O 0.0 {0.533534744398 0.525741653356 0.608793517516} O3 3105 -1 1 {} H 0.0 {0.535435001462 0.524596914444 0.59853248058} H2 3106 -1 8 {} O 0.0 {0.508815327332 0.538445506381 0.597373140774} O4 3107 -1 1 {} H 0.0 {0.500284636993 0.543675519313 0.60055533148} H3 3108 -1 8 {} O 0.0 {0.477787765774 0.513097415398 0.620179324597} O5 3109 -1 1 {} H 0.0 {0.480662133829 0.505153664195 0.626413135866} H4 3110 -1 8 {} O 0.0 {0.485899047079 0.501176560573 0.59387710156} O6 3111 -1 1 {} H 0.0 {0.476103771249 0.502352389603 0.590312291536} H5 3112 -1 8 {} O 0.0 {0.48775890131 0.530854912937 0.5980991635} O7 3113 -1 1 {} H 0.0 {0.488320340525 0.529753683755 0.587678248681} H6 3114 -1 14 {} Si 0.0 {0.442911488728 0.410103966318 0.645097250014} Si1 3115 -1 8 {} O 0.0 {0.447782889313 0.413846063372 0.662441723405} O1 3116 -1 14 {} Si 0.0 {0.436587921754 0.404926423546 0.674018853761} Si2 3117 -1 8 {} O 0.0 {0.42564904816 0.417025832359 0.682549563824} O2 3118 -1 1 {} H 0.0 {0.418277585381 0.420380342095 0.675870850856} H1 3119 -1 8 {} O 0.0 {0.426290834909 0.392960027362 0.664580067276} O3 3120 -1 1 {} H 0.0 {0.430938018704 0.390840694807 0.655409213138} H2 3121 -1 8 {} O 0.0 {0.446625866962 0.395869928328 0.686503699403} O4 3122 -1 1 {} H 0.0 {0.449119000412 0.402377445313 0.694361367022} H3 3123 -1 8 {} O 0.0 {0.424560916489 0.409726402487 0.643838107217} O5 3124 -1 1 {} H 0.0 {0.420408896842 0.415213296759 0.651769705767} H4 3125 -1 8 {} O 0.0 {0.449738115688 0.393732312853 0.640195183073} O6 3126 -1 1 {} H 0.0 {0.456196964633 0.39495897675 0.632004580895} H5 3127 -1 8 {} O 0.0 {0.449558961807 0.423113875723 0.633915238301} O7 3128 -1 1 {} H 0.0 {0.460018239351 0.42343744961 0.634770482471} H6 3129 -1 14 {} Si 0.0 {0.703469768949 0.475477425418 0.430604014829} Si1 3130 -1 8 {} O 0.0 {0.718815176607 0.470483728428 0.421799602031} O1 3131 -1 14 {} Si 0.0 {0.716869229105 0.474184149087 0.40391276779} Si2 3132 -1 8 {} O 0.0 {0.705281724256 0.462062103902 0.396387778139} O3 3133 -1 1 {} H 0.0 {0.695637543475 0.466221238567 0.396079261223} H2 3134 -1 8 {} O 0.0 {0.710039636203 0.491128238278 0.401934159994} O4 3135 -1 1 {} H 0.0 {0.703204473087 0.491235029122 0.393983468231} H3 3136 -1 8 {} O 0.0 {0.704740027685 0.470773127466 0.448339392288} O5 3137 -1 1 {} H 0.0 {0.714476792634 0.472667841046 0.451765809186} H4 3138 -1 8 {} O 0.0 {0.689043620077 0.466983769475 0.422997054016} O6 3139 -1 1 {} H 0.0 {0.68523718847 0.472891994327 0.415191472855} H5 3140 -1 8 {} O 0.0 {0.701282155367 0.493695079903 0.429216767951} O7 3141 -1 1 {} H 0.0 {0.691322287212 0.4958175859 0.426647434525} H6 3142 -1 14 {} Si 0.0 {0.362411123525 0.408322476326 0.644771445766} Si1 3143 -1 8 {} O 0.0 {0.356556568933 0.415410609641 0.660753950319} O1 3144 -1 14 {} Si 0.0 {0.36729832227 0.409607597155 0.674562560298} Si2 3145 -1 8 {} O 0.0 {0.37615870405 0.394288528706 0.669520097085} O2 3146 -1 1 {} H 0.0 {0.371953288721 0.38603512474 0.674467750637} H1 3147 -1 8 {} O 0.0 {0.379551813887 0.42269447703 0.678712085464} O3 3148 -1 1 {} H 0.0 {0.377146680369 0.431498190453 0.673521898001} H2 3149 -1 8 {} O 0.0 {0.34954520763 0.397054058607 0.63799909843} O5 3150 -1 1 {} H 0.0 {0.346397968821 0.40059203763 0.628625724175} H4 3151 -1 8 {} O 0.0 {0.377983651037 0.398900929116 0.647456202072} O6 3152 -1 1 {} H 0.0 {0.378351263207 0.390800387583 0.640767204597} H5 3153 -1 8 {} O 0.0 {0.365475619712 0.421959054949 0.632797125826} O7 3154 -1 1 {} H 0.0 {0.371275772648 0.429398620367 0.637394479446} H6 3155 -1 14 {} Si 0.0 {0.62673782812 0.501885450363 0.663934370824} Si1 3156 -1 8 {} O 0.0 {0.6391925881 0.493911867808 0.653191334727} O1 3157 -1 14 {} Si 0.0 {0.631456417353 0.490540999516 0.6368930973} Si2 3158 -1 8 {} O 0.0 {0.627843750193 0.506480083226 0.628397666045} O2 3159 -1 1 {} H 0.0 {0.632465827601 0.514350651735 0.633605301528} H1 3160 -1 8 {} O 0.0 {0.642860925457 0.480547088075 0.626614524286} O3 3161 -1 1 {} H 0.0 {0.643016014333 0.47068338384 0.630151842165} H2 3162 -1 8 {} O 0.0 {0.615819741421 0.481250555048 0.639426783526} O4 3163 -1 1 {} H 0.0 {0.60789846804 0.488028089161 0.640544648186} H3 3164 -1 8 {} O 0.0 {0.634162693977 0.505577334831 0.680339175295} O5 3165 -1 1 {} H 0.0 {0.637762052398 0.515441763996 0.680378101566} H4 3166 -1 8 {} O 0.0 {0.612445189867 0.49052068896 0.665996330031} O6 3167 -1 1 {} H 0.0 {0.605560512269 0.492167774733 0.658243332039} H5 3168 -1 8 {} O 0.0 {0.621053403653 0.517501713058 0.656084072055} O7 3169 -1 1 {} H 0.0 {0.611894814461 0.520384311118 0.660300621411} H6 3170 -1 14 {} Si 0.0 {0.626941000682 0.489420654153 0.700370059653} Si1 3171 -1 8 {} O 0.0 {0.619653857069 0.490546902472 0.683525919157} O5 3172 -1 1 {} H 0.0 {0.614563140672 0.481626431202 0.681330440073} H4 3173 -1 8 {} O 0.0 {0.616074891562 0.498261598033 0.712341951424} O6 3174 -1 8 {} O 0.0 {0.628399747781 0.471713774905 0.70521729273} O7 3175 -1 14 {} Si 0.0 {0.463045544602 0.586198143843 0.279331663659} Si2 3176 -1 8 {} O 0.0 {0.467888075805 0.569393705408 0.273610806281} O2 3177 -1 1 {} H 0.0 {0.459281249363 0.564021388141 0.270897414396} H1 3178 -1 8 {} O 0.0 {0.471164873479 0.589790474579 0.295422970347} O3 3179 -1 1 {} H 0.0 {0.475734237205 0.599242911484 0.294978501813} H2 3180 -1 8 {} O 0.0 {0.444775384472 0.586977379859 0.28134255891} O4 3181 -1 1 {} H 0.0 {0.440803912902 0.57726570618 0.280932669913} H3 3182 -1 8 {} O 0.0 {0.660845280688 0.340089996964 0.392507683725} O4 3183 -1 1 {} H 0.0 {0.663032565521 0.350334229276 0.391832975779} H3 3184 -1 8 {} O 0.0 {0.475057783317 0.50214755853 0.737387731948} O6 3185 -1 1 {} H 0.0 {0.475854750276 0.504815901689 0.727268484825} H5 3186 -1 14 {} Si 0.0 {0.594073495691 0.481742575839 0.290726496899} Si1 3187 -1 8 {} O 0.0 {0.588435988648 0.465829944749 0.297797716704} O1 3188 -1 14 {} Si 0.0 {0.58825347559 0.466854749954 0.316182513112} Si2 3189 -1 8 {} O 0.0 {0.581965403495 0.450986000576 0.322994461795} O2 3190 -1 1 {} H 0.0 {0.572855580603 0.448556629065 0.318336843448} H1 3191 -1 8 {} O 0.0 {0.605308931246 0.469832567233 0.322412611516} O3 3192 -1 1 {} H 0.0 {0.612039149612 0.463711338932 0.317188847595} H2 3193 -1 8 {} O 0.0 {0.577291931375 0.480654931946 0.321523001095} O4 3194 -1 1 {} H 0.0 {0.571689720861 0.484038433978 0.313314713809} H3 3195 -1 8 {} O 0.0 {0.611647624877 0.480224983822 0.285535459913} O5 3196 -1 1 {} H 0.0 {0.612669019634 0.472007330069 0.279073606712} H4 3197 -1 8 {} O 0.0 {0.592511250796 0.494938635599 0.303401218573} O6 3198 -1 1 {} H 0.0 {0.592503750762 0.490587513566 0.312960094653} H5 3199 -1 8 {} O 0.0 {0.583680229253 0.485923123703 0.276140974255} O7 3200 -1 1 {} H 0.0 {0.573554117062 0.485827747086 0.278933049177} H6 3201 -1 14 {} Si 0.0 {0.284537609 0.541731771775 0.54973212111} Si1 3202 -1 8 {} O 0.0 {0.286174431998 0.55573636535 0.56158988239} O1 3203 -1 14 {} Si 0.0 {0.270876442229 0.565980238587 0.561275091141} Si2 3204 -1 1 {} H 0.0 {0.267786068486 0.571389721154 0.538084208857} H2 3205 -1 8 {} O 0.0 {0.297735034366 0.542943367322 0.536973967452} O5 3206 -1 1 {} H 0.0 {0.304644199493 0.550295793018 0.539809392806} H4 3207 -1 8 {} O 0.0 {0.268080882986 0.542424494154 0.541559849234} O6 3208 -1 1 {} H 0.0 {0.260549553094 0.541608727404 0.548810143299} H5 3209 -1 8 {} O 0.0 {0.286255302515 0.525801088277 0.558808129931} O7 3210 -1 1 {} H 0.0 {0.276739580014 0.522214234571 0.561401953615} H6 3211 -1 14 {} Si 0.0 {0.492750784723 0.539617829791 0.732468826222} Si2 3212 -1 8 {} O 0.0 {0.505720549589 0.526592454132 0.732618526642} O2 3213 -1 1 {} H 0.0 {0.514969889534 0.530921574582 0.735049037521} H1 3214 -1 8 {} O 0.0 {0.480341253332 0.535818903968 0.719451829053} O3 3215 -1 1 {} H 0.0 {0.473638997683 0.543857223798 0.718580190828} H2 3216 -1 8 {} O 0.0 {0.500503651892 0.555915023658 0.728944860849} O4 3217 -1 1 {} H 0.0 {0.510168053999 0.554420085223 0.725108810915} H3 3218 -1 14 {} Si 0.0 {0.295422925277 0.555615083456 0.421270615142} Si1 3219 -1 8 {} O 0.0 {0.303422273366 0.564363029351 0.407235000947} O1 3220 -1 14 {} Si 0.0 {0.290420727559 0.56897940485 0.395160668459} Si2 3221 -1 1 {} H 0.0 {0.300701907092 0.587693038064 0.384211636875} H2 3222 -1 8 {} O 0.0 {0.291890259373 0.558417457059 0.380170759239} O4 3223 -1 8 {} O 0.0 {0.283798190893 0.56706150749 0.429744978755} O5 3224 -1 1 {} H 0.0 {0.287081685591 0.576950029114 0.428467846707} H4 3225 -1 8 {} O 0.0 {0.30821669427 0.549969569566 0.433179039181} O6 3226 -1 1 {} H 0.0 {0.30574965226 0.540367984011 0.436630450768} H5 3227 -1 8 {} O 0.0 {0.286126035574 0.541075703335 0.414864219872} O7 3228 -1 1 {} H 0.0 {0.289269867332 0.532425608859 0.419904733395} H6 3229 -1 14 {} Si 0.0 {0.485383505403 0.559670482439 0.359926936029} Si1 3230 -1 8 {} O 0.0 {0.478217749043 0.575272821604 0.366555699921} O1 3231 -1 14 {} Si 0.0 {0.483649837855 0.589378445655 0.35609005301} Si2 3232 -1 8 {} O 0.0 {0.47325441896 0.604128737941 0.359714052888} O2 3233 -1 1 {} H 0.0 {0.465891773016 0.601573382308 0.366737849307} H1 3234 -1 8 {} O 0.0 {0.501267869453 0.593283730952 0.359705252863} O3 3235 -1 1 {} H 0.0 {0.507286205485 0.589931265278 0.351787615498} H2 3236 -1 8 {} O 0.0 {0.481876220949 0.584848913473 0.338346367963} O4 3237 -1 1 {} H 0.0 {0.473717176221 0.578342169032 0.337208516736} H3 3238 -1 8 {} O 0.0 {0.502325135467 0.557369287113 0.366641757595} O5 3239 -1 1 {} H 0.0 {0.501706897068 0.554207853562 0.376623967623} H4 3240 -1 8 {} O 0.0 {0.486163651774 0.560550993967 0.341589567831} O6 3241 -1 1 {} H 0.0 {0.48926372967 0.551264414873 0.337805681754} H5 3242 -1 8 {} O 0.0 {0.474843431605 0.545457501 0.36492139824} O7 3243 -1 1 {} H 0.0 {0.478347504031 0.541551035725 0.374011374586} H6 3244 -1 8 {} O 0.0 {0.690776490902 0.597074363174 0.396363373268} O6 3245 -1 1 {} H 0.0 {0.689937938482 0.590918207385 0.404854398179} H5 3246 -1 1 {} H 0.0 {0.259737981888 0.543833949974 0.511398066023} H2 3247 -1 14 {} Si 0.0 {0.385485140345 0.450252868793 0.617813567805} Si1 3248 -1 8 {} O 0.0 {0.381788789533 0.443976831128 0.634716460389} O1 3249 -1 14 {} Si 0.0 {0.394710714509 0.431884791805 0.639734883152} Si2 3250 -1 8 {} O 0.0 {0.404938436901 0.439099699168 0.653220462794} O2 3251 -1 1 {} H 0.0 {0.414939506314 0.43967334814 0.650076960886} H1 3252 -1 8 {} O 0.0 {0.386667633333 0.416470470372 0.64573071143} O3 3253 -1 1 {} H 0.0 {0.379483201632 0.418882520066 0.652994212824} H2 3254 -1 8 {} O 0.0 {0.405434082474 0.427998309001 0.625315356962} O4 3255 -1 1 {} H 0.0 {0.415508800611 0.428833716961 0.628138409482} H3 3256 -1 8 {} O 0.0 {0.378128237243 0.466977090457 0.615788051795} O5 3257 -1 1 {} H 0.0 {0.376814486523 0.47137824738 0.625227478921} H4 3258 -1 8 {} O 0.0 {0.378292909111 0.43881990386 0.605316169084} O6 3259 -1 1 {} H 0.0 {0.383873661285 0.42993133836 0.605081391241} H5 3260 -1 8 {} O 0.0 {0.403711452826 0.451254924503 0.615486796287} O7 3261 -1 1 {} H 0.0 {0.408539181956 0.44720251817 0.623878074371} H6 3262 -1 14 {} Si 0.0 {0.420579612058 0.267061588036 0.443251162835} Si2 3263 -1 8 {} O 0.0 {0.432509282583 0.253166325239 0.441574715806} O2 3264 -1 8 {} O 0.0 {0.419382766778 0.276076177206 0.42725595487} O3 3265 -1 1 {} H 0.0 {0.413634724651 0.284764803955 0.428568354035} H2 3266 -1 8 {} O 0.0 {0.426405759505 0.278601986823 0.456364113882} O4 3267 -1 1 {} H 0.0 {0.419650854944 0.278464892509 0.464398844501} H3 3268 -1 14 {} Si 0.0 {0.575276841167 0.277242491641 0.411952439991} Si1 3269 -1 8 {} O 0.0 {0.589746259443 0.285899458369 0.419292423438} O5 3270 -1 1 {} H 0.0 {0.59829897433 0.279883703113 0.418246798677} H4 3271 -1 8 {} O 0.0 {0.560140997169 0.287427106363 0.414281613979} O6 3272 -1 1 {} H 0.0 {0.551721555333 0.281159191565 0.414490067195} H5 3273 -1 8 {} O 0.0 {0.578203514483 0.274570497241 0.393986049054} O7 3274 -1 14 {} Si 0.0 {0.378182332982 0.565745760266 0.539916731868} Si1 3275 -1 8 {} O 0.0 {0.381013126792 0.582746074582 0.546139944274} O1 3276 -1 14 {} Si 0.0 {0.399029619091 0.586071233456 0.546200788367} Si2 3277 -1 8 {} O 0.0 {0.407423838529 0.573977741926 0.557226090374} O2 3278 -1 1 {} H 0.0 {0.405520877752 0.576505062809 0.567244285428} H1 3279 -1 8 {} O 0.0 {0.405617106364 0.58443228208 0.52910258025} O3 3280 -1 1 {} H 0.0 {0.402147703238 0.592436889553 0.523255455119} H2 3281 -1 8 {} O 0.0 {0.402089603077 0.603045229209 0.5523400983} O4 3282 -1 1 {} H 0.0 {0.406650509689 0.602539638391 0.561756408386} H3 3283 -1 8 {} O 0.0 {0.362554654024 0.565309344753 0.530300369364} O5 3284 -1 1 {} H 0.0 {0.36341675575 0.571588928848 0.52194603697} H4 3285 -1 8 {} O 0.0 {0.377100319128 0.554136510276 0.554142129505} O6 3286 -1 1 {} H 0.0 {0.38590948632 0.554771216704 0.559843987209} H5 3287 -1 8 {} O 0.0 {0.392211595544 0.560849722074 0.529073411778} O7 3288 -1 1 {} H 0.0 {0.4007673169 0.566313926648 0.531761928315} H6 3289 -1 14 {} Si 0.0 {0.583896301674 0.351540813865 0.365318632132} Si1 3290 -1 8 {} O 0.0 {0.56705218352 0.344251701431 0.366840018869} O1 3291 -1 14 {} Si 0.0 {0.562661853299 0.342278540313 0.384620001041} Si2 3292 -1 8 {} O 0.0 {0.565252512138 0.35822362641 0.393453897355} O2 3293 -1 1 {} H 0.0 {0.568675153643 0.365460750926 0.386669533448} H1 3294 -1 8 {} O 0.0 {0.545003995776 0.337310290971 0.386018322561} O3 3295 -1 1 {} H 0.0 {0.542345728222 0.331511509644 0.377673844725} H2 3296 -1 8 {} O 0.0 {0.573270087027 0.329283510383 0.392171688802} O4 3297 -1 1 {} H 0.0 {0.583273706572 0.332420918246 0.392013478756} H3 3298 -1 8 {} O 0.0 {0.582614592907 0.369879398839 0.364999733827} O5 3299 -1 1 {} H 0.0 {0.585533149407 0.373751434718 0.374296553998} H4 3300 -1 8 {} O 0.0 {0.591721400001 0.345650970507 0.349723739237} O6 3301 -1 1 {} H 0.0 {0.598444788637 0.337880009212 0.351897632913} H5 3302 -1 8 {} O 0.0 {0.594193372682 0.34640100694 0.37967164022} O7 3303 -1 1 {} H 0.0 {0.593774733212 0.335975742156 0.380701592927} H6 3304 -1 14 {} Si 0.0 {0.544256799781 0.347216702826 0.438571595248} Si1 3305 -1 8 {} O 0.0 {0.543776143555 0.342701560972 0.456392177861} O1 3306 -1 14 {} Si 0.0 {0.53331320345 0.354816459737 0.465503524502} Si2 3307 -1 8 {} O 0.0 {0.517547279728 0.357451218102 0.456374403709} O2 3308 -1 1 {} H 0.0 {0.515173568468 0.34879846515 0.450926794474} H1 3309 -1 8 {} O 0.0 {0.529656697603 0.348303269438 0.482309490022} O3 3310 -1 1 {} H 0.0 {0.53865434893 0.345831013305 0.487122670633} H2 3311 -1 8 {} O 0.0 {0.542288051548 0.37081213818 0.466963065492} O4 3312 -1 1 {} H 0.0 {0.53567867911 0.378213093787 0.470406180198} H3 3313 -1 8 {} O 0.0 {0.531746462547 0.360266688861 0.43526574253} O5 3314 -1 1 {} H 0.0 {0.536269294289 0.369713462613 0.436021756979} H4 3315 -1 8 {} O 0.0 {0.54049199244 0.332373051705 0.428365328218} O6 3316 -1 1 {} H 0.0 {0.546899499219 0.33214053418 0.420047379392} H5 3317 -1 8 {} O 0.0 {0.561002640469 0.353526739376 0.43427554494} O7 3318 -1 1 {} H 0.0 {0.564466692637 0.34863935832 0.425649756328} H6 3319 -1 1 {} H 0.0 {0.29154016906 0.391376925371 0.588611300646} H6 3320 -1 14 {} Si 0.0 {0.647827695696 0.629621284009 0.428979501911} Si1 3321 -1 8 {} O 0.0 {0.635270449736 0.625403490132 0.416204789968} O1 3322 -1 14 {} Si 0.0 {0.639995674969 0.632941190499 0.400080655976} Si2 3323 -1 8 {} O 0.0 {0.629157883078 0.626240541646 0.386859632793} O2 3324 -1 1 {} H 0.0 {0.62353930508 0.618258700946 0.390697107896} H1 3325 -1 8 {} O 0.0 {0.637975002169 0.651177628561 0.400975780821} O3 3326 -1 1 {} H 0.0 {0.64680183295 0.655467899142 0.404694418186} H2 3327 -1 8 {} O 0.0 {0.657523278548 0.628898277756 0.396243309476} O4 3328 -1 1 {} H 0.0 {0.662289071546 0.625450296491 0.404922486803} H3 3329 -1 8 {} O 0.0 {0.63942206172 0.636867929475 0.443662050899} O5 3330 -1 1 {} H 0.0 {0.646051433595 0.636921631583 0.451804968105} H4 3331 -1 8 {} O 0.0 {0.659768383886 0.641810266214 0.422106567906} O6 3332 -1 1 {} H 0.0 {0.668687316353 0.63689322222 0.419553903378} H5 3333 -1 8 {} O 0.0 {0.656816505085 0.614367683052 0.4339863508} O7 3334 -1 1 {} H 0.0 {0.665236952784 0.613108489032 0.42784614876} H6 3335 -1 14 {} Si 0.0 {0.477207017959 0.704574149824 0.608029070646} Si1 3336 -1 8 {} O 0.0 {0.492036698296 0.713165569733 0.601429249981} O1 3337 -1 14 {} Si 0.0 {0.497382988584 0.705157337773 0.585775056519} Si2 3338 -1 8 {} O 0.0 {0.512831658094 0.695734776563 0.588819061106} O2 3339 -1 1 {} H 0.0 {0.51662470386 0.698221746651 0.598275275542} H1 3340 -1 8 {} O 0.0 {0.484304412565 0.693684399956 0.579795610942} O3 3341 -1 1 {} H 0.0 {0.479023298631 0.698194479483 0.571936034549} H2 3342 -1 8 {} O 0.0 {0.500465631991 0.718091849107 0.573055378605} O4 3343 -1 8 {} O 0.0 {0.465398532643 0.701321953743 0.594325853755} O5 3344 -1 1 {} H 0.0 {0.463458921175 0.710265165125 0.589193205385} H4 3345 -1 8 {} O 0.0 {0.482236862982 0.688651031317 0.615770297228} O7 3346 -1 1 {} H 0.0 {0.483123267712 0.689945201611 0.626155632042} H6 3347 -1 14 {} Si 0.0 {0.56468969675 0.322896754794 0.530250312581} Si1 3348 -1 8 {} O 0.0 {0.579523838766 0.333616992377 0.532068726073} O1 3349 -1 14 {} Si 0.0 {0.594222531796 0.323178270181 0.535544371815} Si2 3350 -1 8 {} O 0.0 {0.591228675851 0.313240846254 0.550747049643} O2 3351 -1 1 {} H 0.0 {0.589771922482 0.319682336526 0.558888168346} H1 3352 -1 8 {} O 0.0 {0.597222020809 0.311868720453 0.521327993471} O3 3353 -1 1 {} H 0.0 {0.599314801725 0.317529288823 0.512748579044} H2 3354 -1 8 {} O 0.0 {0.608909803003 0.333969836304 0.538064589868} O4 3355 -1 1 {} H 0.0 {0.606549516889 0.343798575423 0.535209491807} H3 3356 -1 8 {} O 0.0 {0.569263010349 0.305374373269 0.533630211009} O5 3357 -1 1 {} H 0.0 {0.574623915028 0.304827274735 0.542630520442} H4 3358 -1 8 {} O 0.0 {0.558197400004 0.324316440012 0.513074427774} O6 3359 -1 1 {} H 0.0 {0.554971539076 0.33416185303 0.511368049188} H5 3360 -1 8 {} O 0.0 {0.551834018142 0.328335313967 0.542126426867} O7 3361 -1 1 {} H 0.0 {0.551886430846 0.338809808263 0.542762389823} H6 3362 -1 14 {} Si 0.0 {0.585726590286 0.317434231559 0.598206818739} Si1 3363 -1 8 {} O 0.0 {0.598518980776 0.322432784944 0.61063315944} O1 3364 -1 14 {} Si 0.0 {0.596771090383 0.312545737466 0.62617019413} Si2 3365 -1 8 {} O 0.0 {0.579250380359 0.312859445522 0.631767612788} O2 3366 -1 1 {} H 0.0 {0.576506358989 0.322718069431 0.634097688588} H1 3367 -1 8 {} O 0.0 {0.607511966186 0.319808467079 0.639268118457} O4 3368 -1 8 {} O 0.0 {0.570509099176 0.327612863886 0.600487121636} O5 3369 -1 1 {} H 0.0 {0.570280110577 0.33524915201 0.59329937821} H4 3370 -1 8 {} O 0.0 {0.581501092309 0.299657166236 0.600384235785} O6 3371 -1 1 {} H 0.0 {0.589984975064 0.29442657322 0.603600778791} H5 3372 -1 8 {} O 0.0 {0.592374919597 0.320087697199 0.581269125647} O7 3373 -1 1 {} H 0.0 {0.602447579874 0.317166036987 0.580985318885} H6 3374 -1 14 {} Si 0.0 {0.460603362512 0.49056670355 0.685988710911} Si1 3375 -1 8 {} O 0.0 {0.454919543096 0.489380098485 0.703412994671} O1 3376 -1 14 {} Si 0.0 {0.462511252924 0.474599003838 0.711296946257} Si2 3377 -1 8 {} O 0.0 {0.450555800641 0.460630104288 0.710863105255} O2 3378 -1 1 {} H 0.0 {0.443219488278 0.462101723381 0.718225129071} H1 3379 -1 8 {} O 0.0 {0.477780220377 0.469879852013 0.702158284149} O3 3380 -1 1 {} H 0.0 {0.486072975406 0.474620683633 0.706536792948} H2 3381 -1 8 {} O 0.0 {0.466780272617 0.478480838143 0.728751219871} O4 3382 -1 1 {} H 0.0 {0.468506038042 0.469550436955 0.733984740218} H3 3383 -1 8 {} O 0.0 {0.459625034097 0.508081467263 0.680403929172} O5 3384 -1 1 {} H 0.0 {0.453204154539 0.513425396805 0.686779915363} H4 3385 -1 8 {} O 0.0 {0.449917715892 0.480094766898 0.675307999788} O6 3386 -1 1 {} H 0.0 {0.455537253424 0.472029649204 0.671606729647} H5 3387 -1 8 {} O 0.0 {0.477964068338 0.484653272923 0.68485537024} O7 3388 -1 1 {} H 0.0 {0.482282828405 0.4846639577 0.694397488955} H6 3389 -1 14 {} Si 0.0 {0.418912456543 0.492529278665 0.695016380369} Si1 3390 -1 8 {} O 0.0 {0.422852422471 0.510413034673 0.693170462001} O1 3391 -1 14 {} Si 0.0 {0.411166607563 0.518041907967 0.681181638645} Si2 3392 -1 8 {} O 0.0 {0.405793764557 0.534468177488 0.687465046254} O2 3393 -1 1 {} H 0.0 {0.413070537241 0.538256053281 0.694008302302} H1 3394 -1 8 {} O 0.0 {0.419532748848 0.520191611377 0.66494757798} O3 3395 -1 1 {} H 0.0 {0.425142876335 0.511605365086 0.662756689163} H2 3396 -1 8 {} O 0.0 {0.396495952912 0.507111267308 0.679125443338} O4 3397 -1 1 {} H 0.0 {0.387736739536 0.512846612726 0.679831164187} H3 3398 -1 8 {} O 0.0 {0.401984976833 0.489274401886 0.688575185914} O5 3399 -1 1 {} H 0.0 {0.402594162724 0.482965348279 0.680203768322} H4 3400 -1 8 {} O 0.0 {0.419699422926 0.487872902514 0.71279770367} O6 3401 -1 1 {} H 0.0 {0.429268403698 0.484158564075 0.715009272133} H5 3402 -1 8 {} O 0.0 {0.431108681236 0.482554663089 0.685526486008} O7 3403 -1 1 {} H 0.0 {0.433250771802 0.473729497492 0.690796016073} H6 3404 -1 8 {} O 0.0 {0.292964510198 0.610511582661 0.479049455816} O6 3405 -1 1 {} H 0.0 {0.299165588565 0.609655732477 0.487474633883} H5 3406 -1 8 {} O 0.0 {0.368892790972 0.49435037236 0.289668746002} O3 3407 -1 1 {} H 0.0 {0.376974217642 0.490748519125 0.284009779434} H2 3408 -1 8 {} O 0.0 {0.370640495859 0.523922068002 0.28467756552} O4 3409 -1 14 {} Si 0.0 {0.316298261438 0.491528445284 0.371620937086} Si1 3410 -1 8 {} O 0.0 {0.324096955086 0.499783196521 0.357145721739} O1 3411 -1 14 {} Si 0.0 {0.311185448388 0.504713976022 0.345011384937} Si2 3412 -1 8 {} O 0.0 {0.295245550638 0.508113035899 0.353796196906} O2 3413 -1 1 {} H 0.0 {0.292090273124 0.499507071065 0.358881268292} H1 3414 -1 8 {} O 0.0 {0.316636811348 0.519901781866 0.336198359534} O3 3415 -1 1 {} H 0.0 {0.323359702744 0.517256855557 0.328585889259} H2 3416 -1 8 {} O 0.0 {0.308807711292 0.491296358042 0.332708049225} O4 3417 -1 8 {} O 0.0 {0.313537424458 0.473751683294 0.36778496457} O5 3418 -1 1 {} H 0.0 {0.314558389693 0.468089915026 0.376567684542} H4 3419 -1 8 {} O 0.0 {0.3001674919 0.499564993181 0.375447347818} O6 3420 -1 1 {} H 0.0 {0.301836964675 0.509396568694 0.378745269356} H5 3421 -1 8 {} O 0.0 {0.327505492265 0.492989665669 0.386133879228} O7 3422 -1 1 {} H 0.0 {0.335653371102 0.499140498709 0.383631859576} H6 3423 -1 14 {} Si 0.0 {0.340154134587 0.427407622644 0.368489508937} Si1 3424 -1 8 {} O 0.0 {0.345445332484 0.422780391059 0.385431067656} O1 3425 -1 14 {} Si 0.0 {0.358410473989 0.434457602466 0.39121259901} Si2 3426 -1 8 {} O 0.0 {0.360601087109 0.432580869938 0.409378343394} O2 3427 -1 1 {} H 0.0 {0.352097453459 0.427967171982 0.413457725168} H1 3428 -1 8 {} O 0.0 {0.374269182088 0.430756088125 0.382649224629} O3 3429 -1 1 {} H 0.0 {0.376822631108 0.438815664759 0.376408966649} H2 3430 -1 8 {} O 0.0 {0.353326599427 0.451715360821 0.387406915107} O4 3431 -1 1 {} H 0.0 {0.344007595278 0.45163056941 0.382600621056} H3 3432 -1 8 {} O 0.0 {0.35358805916 0.436937654306 0.360259354346} O5 3433 -1 1 {} H 0.0 {0.362076987888 0.430815796175 0.359219084988} H4 3434 -1 8 {} O 0.0 {0.324920625858 0.437702757129 0.369514776621} O6 3435 -1 1 {} H 0.0 {0.318120394636 0.43461516114 0.36215501735} H5 3436 -1 8 {} O 0.0 {0.336655686316 0.412171871638 0.358799065842} O7 3437 -1 1 {} H 0.0 {0.335141875824 0.404131476327 0.365375489878} H6 3438 -1 14 {} Si 0.0 {0.49660519673 0.614463585662 0.560302644719} Si1 3439 -1 8 {} O 0.0 {0.513963872094 0.617554122395 0.554858938141} O1 3440 -1 14 {} Si 0.0 {0.517307438533 0.607875572373 0.539544502331} Si2 3441 -1 8 {} O 0.0 {0.519411135624 0.590103460856 0.543856111164} O2 3442 -1 1 {} H 0.0 {0.528591569508 0.588765027306 0.548767965189} H1 3443 -1 8 {} O 0.0 {0.503062208932 0.60971184677 0.528082897394} O3 3444 -1 1 {} H 0.0 {0.494748494706 0.613275246636 0.533426712374} H2 3445 -1 8 {} O 0.0 {0.532636713358 0.61409451866 0.531295779533} O4 3446 -1 1 {} H 0.0 {0.539545742113 0.617272120111 0.538539765613} H3 3447 -1 8 {} O 0.0 {0.490608915975 0.598727487507 0.552913133991} O5 3448 -1 1 {} H 0.0 {0.492103149707 0.590893508274 0.559719274693} H4 3449 -1 8 {} O 0.0 {0.485780910817 0.628257225854 0.554708391504} O6 3450 -1 1 {} H 0.0 {0.478328938708 0.629982208146 0.561894436596} H5 3451 -1 8 {} O 0.0 {0.496020088721 0.613259892957 0.578658566203} O7 3452 -1 1 {} H 0.0 {0.491917659648 0.622086439852 0.582610405934} H6 3453 -1 14 {} Si 0.0 {0.581014606056 0.3568098883 0.577102016327} Si1 3454 -1 8 {} O 0.0 {0.585800698463 0.374151891844 0.573458114195} O1 3455 -1 14 {} Si 0.0 {0.579561455368 0.385021922368 0.586855280416} Si2 3456 -1 8 {} O 0.0 {0.589527399534 0.400467842114 0.587362457258} O2 3457 -1 1 {} H 0.0 {0.59408760944 0.401359153842 0.596775653706} H1 3458 -1 8 {} O 0.0 {0.561934660873 0.389154156516 0.583629597272} O3 3459 -1 1 {} H 0.0 {0.557239653168 0.380986616148 0.578976878443} H2 3460 -1 8 {} O 0.0 {0.580965928118 0.376264636631 0.602974146396} O4 3461 -1 1 {} H 0.0 {0.579413188656 0.383085487067 0.610795508307} H3 3462 -1 8 {} O 0.0 {0.570040252656 0.350545177255 0.563727236579} O5 3463 -1 1 {} H 0.0 {0.570470073769 0.357073507742 0.555515658692} H4 3464 -1 8 {} O 0.0 {0.572063818443 0.356153928772 0.593176118977} O6 3465 -1 1 {} H 0.0 {0.577608386474 0.350476082416 0.600039420611} H5 3466 -1 8 {} O 0.0 {0.596178388493 0.34637671328 0.57800036045} O7 3467 -1 1 {} H 0.0 {0.599093261708 0.345319877376 0.588009133218} H6 3468 -1 14 {} Si 0.0 {0.692791893119 0.377255192856 0.542363763464} Si1 3469 -1 8 {} O 0.0 {0.702314244708 0.380811747011 0.526957244231} O1 3470 -1 14 {} Si 0.0 {0.71833998204 0.388976021627 0.531088371879} Si2 3471 -1 8 {} O 0.0 {0.71510379727 0.405234502152 0.539095453725} O2 3472 -1 1 {} H 0.0 {0.709033457161 0.403822916416 0.547541371676} H1 3473 -1 8 {} O 0.0 {0.692523385342 0.359079170756 0.545299062521} O5 3474 -1 1 {} H 0.0 {0.691276064763 0.357212576989 0.555550933202} H4 3475 -1 8 {} O 0.0 {0.675531748544 0.383383025376 0.540482814601} O6 3476 -1 1 {} H 0.0 {0.674133786485 0.391805639188 0.546605109067} H5 3477 -1 8 {} O 0.0 {0.700721809705 0.385686166778 0.556644773699} O7 3478 -1 1 {} H 0.0 {0.693311884682 0.390120873705 0.562627376439} H6 3479 -1 8 {} O 0.0 {0.478789806997 0.728704224918 0.537895658159} O1 3480 -1 14 {} Si 0.0 {0.46762207307 0.716618173346 0.546155009589} Si2 3481 -1 8 {} O 0.0 {0.466469434071 0.701363550343 0.535919495382} O2 3482 -1 1 {} H 0.0 {0.474686313683 0.695155484548 0.537972564269} H1 3483 -1 8 {} O 0.0 {0.474345289728 0.712371637618 0.562740368748} O3 3484 -1 1 {} H 0.0 {0.481332156316 0.719645038245 0.565641533675} H2 3485 -1 8 {} O 0.0 {0.450881505949 0.724009446776 0.548035215817} O4 3486 -1 1 {} H 0.0 {0.446430102342 0.725015965805 0.538581557652} H3 3487 -1 1 {} H 0.0 {0.263959826569 0.426039764914 0.533745307048} H4 3488 -1 14 {} Si 0.0 {0.332957734965 0.580488152224 0.362040334177} Si1 3489 -1 8 {} O 0.0 {0.348491550644 0.575239756286 0.353756310128} O1 3490 -1 14 {} Si 0.0 {0.353767360926 0.588267997786 0.341910961122} Si2 3491 -1 8 {} O 0.0 {0.341571095545 0.589354674664 0.32820866594} O2 3492 -1 1 {} H 0.0 {0.340764456499 0.579997714123 0.323517464562} H1 3493 -1 8 {} O 0.0 {0.354738507276 0.604467599223 0.350588676755} O3 3494 -1 1 {} H 0.0 {0.363883088509 0.605155908483 0.355699236894} H2 3495 -1 8 {} O 0.0 {0.370277007449 0.583943425278 0.335070080884} O4 3496 -1 1 {} H 0.0 {0.36976634659 0.574529986325 0.330444191309} H3 3497 -1 8 {} O 0.0 {0.321178070986 0.587004678523 0.349479634507} O5 3498 -1 8 {} O 0.0 {0.336773871716 0.593634739867 0.374329017044} O6 3499 -1 1 {} H 0.0 {0.340175641656 0.589216027632 0.383219595188} H5 3500 -1 8 {} O 0.0 {0.325442089758 0.56604476114 0.370603166364} O7 3501 -1 1 {} H 0.0 {0.332563496403 0.558363216935 0.371376305247} H6 3502 -1 14 {} Si 0.0 {0.521791908208 0.653639882414 0.422094575431} Si1 3503 -1 8 {} O 0.0 {0.522382512216 0.63921437769 0.433511369061} O1 3504 -1 14 {} Si 0.0 {0.507023525375 0.638885927857 0.443611839785} Si2 3505 -1 8 {} O 0.0 {0.50649264189 0.62335092448 0.453399830276} O2 3506 -1 1 {} H 0.0 {0.515983603896 0.621483180621 0.457487878321} H1 3507 -1 8 {} O 0.0 {0.506846979823 0.653330197834 0.455002485272} O3 3508 -1 1 {} H 0.0 {0.499219089304 0.659948257876 0.452122467859} H2 3509 -1 8 {} O 0.0 {0.492368531329 0.639668426795 0.432517174535} O4 3510 -1 1 {} H 0.0 {0.487691716003 0.63027818952 0.432245303743} H3 3511 -1 8 {} O 0.0 {0.524435080646 0.669141520624 0.431631449713} O5 3512 -1 1 {} H 0.0 {0.534122309774 0.669112927548 0.435711430697} H4 3513 -1 8 {} O 0.0 {0.50548623745 0.654090688648 0.4140215623} O6 3514 -1 1 {} H 0.0 {0.500071571365 0.645476261871 0.416651959607} H5 3515 -1 8 {} O 0.0 {0.534872656072 0.65205414718 0.409236893358} O7 3516 -1 1 {} H 0.0 {0.531202321491 0.646355182765 0.401220785545} H6 3517 -1 14 {} Si 0.0 {0.385649515085 0.411886718195 0.384320440442} Si1 3518 -1 8 {} O 0.0 {0.367915350683 0.412474229867 0.389631150067} O1 3519 -1 14 {} Si 0.0 {0.361309783407 0.39530330443 0.392241186838} Si2 3520 -1 8 {} O 0.0 {0.348827643783 0.391527857488 0.379262781973} O2 3521 -1 1 {} H 0.0 {0.352603324849 0.394316787513 0.369875715333} H1 3522 -1 8 {} O 0.0 {0.375058666067 0.383132708676 0.391259155081} O3 3523 -1 1 {} H 0.0 {0.377453097004 0.379819355245 0.400934932436} H2 3524 -1 8 {} O 0.0 {0.353388580789 0.394127102587 0.408843203969} O4 3525 -1 1 {} H 0.0 {0.344021595021 0.389466829651 0.407916963876} H3 3526 -1 8 {} O 0.0 {0.391081454941 0.394346322049 0.382780620999} O5 3527 -1 1 {} H 0.0 {0.394253890759 0.392525944332 0.372957239512} H4 3528 -1 8 {} O 0.0 {0.396063579458 0.420362601632 0.39687466416} O6 3529 -1 1 {} H 0.0 {0.398494322627 0.413581042079 0.40451160352} H5 3530 -1 8 {} O 0.0 {0.387508810577 0.420345710713 0.368095826587} O7 3531 -1 1 {} H 0.0 {0.391375844333 0.429990603568 0.369616795627} H6 3532 -1 1 {} H 0.0 {0.419615106833 0.432382833772 0.264172568816} H5 3533 -1 14 {} Si 0.0 {0.536378694363 0.275021895161 0.569148371943} Si1 3534 -1 8 {} O 0.0 {0.5402442054 0.283313082972 0.585120458873} O1 3535 -1 14 {} Si 0.0 {0.53600467711 0.272031955886 0.599038445521} Si2 3536 -1 1 {} H 0.0 {0.555185690329 0.277780167571 0.612323922969} H2 3537 -1 8 {} O 0.0 {0.523239276211 0.279951533942 0.609675692832} O4 3538 -1 1 {} H 0.0 {0.513800312008 0.275998940097 0.60731409186} H3 3539 -1 8 {} O 0.0 {0.519268445206 0.279379804562 0.563958800422} O5 3540 -1 1 {} H 0.0 {0.516634242755 0.273717745556 0.555516887186} H4 3541 -1 8 {} O 0.0 {0.537714361194 0.2567972581 0.571213692959} O6 3542 -1 8 {} O 0.0 {0.54829884301 0.280609835251 0.556287016534} O7 3543 -1 1 {} H 0.0 {0.558056155495 0.278101922117 0.559251363153} H6 3544 -1 14 {} Si 0.0 {0.506955283335 0.557862450139 0.487511286477} Si1 3545 -1 8 {} O 0.0 {0.513901892341 0.574077100189 0.482254188779} O1 3546 -1 14 {} Si 0.0 {0.52416136741 0.581099641178 0.495828024109} Si2 3547 -1 8 {} O 0.0 {0.521178100433 0.571659136428 0.511333599951} O2 3548 -1 1 {} H 0.0 {0.516472017731 0.577887623858 0.518356993311} H1 3549 -1 8 {} O 0.0 {0.541947009863 0.579955118405 0.491268818267} O3 3550 -1 1 {} H 0.0 {0.54296164663 0.574048609249 0.482645833331} H2 3551 -1 8 {} O 0.0 {0.519622109957 0.59874374611 0.498424838003} O4 3552 -1 1 {} H 0.0 {0.525640306272 0.602814048879 0.506004665581} H3 3553 -1 8 {} O 0.0 {0.509833169934 0.555467043694 0.505517550981} O5 3554 -1 1 {} H 0.0 {0.501151092975 0.551560973748 0.509944546763} H4 3555 -1 8 {} O 0.0 {0.515190725723 0.544331965726 0.478138493838} O6 3556 -1 1 {} H 0.0 {0.509455820208 0.541940604337 0.469686489835} H5 3557 -1 8 {} O 0.0 {0.488869625443 0.55757950134 0.48410405773} O7 3558 -1 1 {} H 0.0 {0.48516401235 0.547894299645 0.485725630638} H6 3559 -1 14 {} Si 0.0 {0.383377633409 0.617950363289 0.595532820373} Si1 3560 -1 8 {} O 0.0 {0.380395067073 0.612342599645 0.612800392609} O1 3561 -1 14 {} Si 0.0 {0.385548393289 0.594773139517 0.614631800736} Si2 3562 -1 8 {} O 0.0 {0.371817641075 0.583756619606 0.609282686352} O2 3563 -1 1 {} H 0.0 {0.366104756921 0.580991133641 0.61764390177} H1 3564 -1 8 {} O 0.0 {0.400395256723 0.591542366178 0.604231736293} O3 3565 -1 1 {} H 0.0 {0.40818700002 0.597931817161 0.607174607382} H2 3566 -1 8 {} O 0.0 {0.389550227109 0.591454950355 0.632289114178} O4 3567 -1 1 {} H 0.0 {0.381925117555 0.595313156347 0.638377123537} H3 3568 -1 8 {} O 0.0 {0.371163022152 0.630983664132 0.591189222717} O5 3569 -1 1 {} H 0.0 {0.36169042546 0.628215808537 0.594774682425} H4 3570 -1 8 {} O 0.0 {0.381507702693 0.603741643655 0.583989978168} O6 3571 -1 1 {} H 0.0 {0.385255889725 0.59505032377 0.588513426453} H5 3572 -1 8 {} O 0.0 {0.400405722024 0.624800557539 0.594159305121} O7 3573 -1 1 {} H 0.0 {0.400757698764 0.634229851065 0.598766564278} H6 3574 -1 14 {} Si 0.0 {0.528620637012 0.391119099518 0.428209305874} Si1 3575 -1 8 {} O 0.0 {0.546846856395 0.391487261643 0.425578035084} O1 3576 -1 14 {} Si 0.0 {0.555461144422 0.388744809494 0.441617337505} Si2 3577 -1 8 {} O 0.0 {0.556131958242 0.370714617726 0.445222271712} O2 3578 -1 1 {} H 0.0 {0.546757945348 0.367491422701 0.448669536501} H1 3579 -1 8 {} O 0.0 {0.572573639187 0.395431730998 0.440621682202} O3 3580 -1 1 {} H 0.0 {0.572563827859 0.405505696006 0.443581013536} H2 3581 -1 8 {} O 0.0 {0.546297630256 0.397338648835 0.455046018411} O4 3582 -1 1 {} H 0.0 {0.538178103079 0.391414741015 0.458059146009} H3 3583 -1 8 {} O 0.0 {0.521381797292 0.376834301475 0.419138733141} O5 3584 -1 1 {} H 0.0 {0.525709327512 0.367940579868 0.422596811765} H4 3585 -1 8 {} O 0.0 {0.521197815194 0.406718147165 0.421913840125} O6 3586 -1 1 {} H 0.0 {0.512164866346 0.408554578033 0.426939830842} H5 3587 -1 8 {} O 0.0 {0.525019653742 0.389457192368 0.446180996566} O7 3588 -1 1 {} H 0.0 {0.524262265994 0.399013957913 0.450483212409} H6 3589 -1 14 {} Si 0.0 {0.420371961556 0.37528063342 0.329017764855} Si1 3590 -1 8 {} O 0.0 {0.421071297927 0.389535243805 0.340615992401} O1 3591 -1 14 {} Si 0.0 {0.406076362787 0.399934655987 0.338334884777} Si2 3592 -1 8 {} O 0.0 {0.40900778304 0.412044443458 0.324799704513} O2 3593 -1 1 {} H 0.0 {0.415152423357 0.4197931843 0.328321460041} H1 3594 -1 8 {} O 0.0 {0.39179864786 0.389190925691 0.333969724057} O3 3595 -1 1 {} H 0.0 {0.392338774387 0.380266559101 0.339478593983} H2 3596 -1 8 {} O 0.0 {0.402420184291 0.408950114142 0.353942800504} O4 3597 -1 1 {} H 0.0 {0.398779629877 0.41852892807 0.351658658243} H3 3598 -1 8 {} O 0.0 {0.40282030537 0.370720048802 0.325943758631} O5 3599 -1 1 {} H 0.0 {0.399828684261 0.374479061792 0.316600845988} H4 3600 -1 8 {} O 0.0 {0.429269063791 0.360938390664 0.336318070604} O6 3601 -1 1 {} H 0.0 {0.425423057993 0.358940785143 0.345864084628} H5 3602 -1 8 {} O 0.0 {0.428325457795 0.379894174456 0.313149326444} O7 3603 -1 1 {} H 0.0 {0.431681467141 0.37119627857 0.308332464155} H6 3604 -1 14 {} Si 0.0 {0.666557751485 0.432780661057 0.588559164473} Si1 3605 -1 8 {} O 0.0 {0.671737680727 0.448122984768 0.580008777125} O1 3606 -1 14 {} Si 0.0 {0.658814278855 0.452399993446 0.567731305555} Si2 3607 -1 8 {} O 0.0 {0.642322312145 0.451643548059 0.57579251237} O2 3608 -1 1 {} H 0.0 {0.643549635484 0.450706475322 0.58618409698} H1 3609 -1 8 {} O 0.0 {0.661738673152 0.469322567088 0.561204152298} O3 3610 -1 1 {} H 0.0 {0.671879229393 0.47175632303 0.562272356584} H2 3611 -1 8 {} O 0.0 {0.659336877241 0.440289894499 0.553984295314} O4 3612 -1 1 {} H 0.0 {0.652331229991 0.432718638113 0.555833643577} H3 3613 -1 8 {} O 0.0 {0.67450257622 0.418291561609 0.580519935156} O5 3614 -1 1 {} H 0.0 {0.680785769198 0.413498127437 0.587420455519} H4 3615 -1 8 {} O 0.0 {0.64821703296 0.431251547683 0.587336633441} O6 3616 -1 1 {} H 0.0 {0.644692308766 0.424833423416 0.594796527642} H5 3617 -1 8 {} O 0.0 {0.671648227993 0.433519217998 0.606190428888} O7 3618 -1 1 {} H 0.0 {0.66423720622 0.438341894427 0.611718616681} H6 3619 -1 14 {} Si 0.0 {0.43548051807 0.355744952536 0.624210074017} Si1 3620 -1 8 {} O 0.0 {0.426316133946 0.339995193623 0.626967224729} O1 3621 -1 14 {} Si 0.0 {0.410499035597 0.343471069628 0.635734987263} Si2 3622 -1 8 {} O 0.0 {0.404286995249 0.328019144742 0.643588899502} O2 3623 -1 1 {} H 0.0 {0.407879938143 0.319707783901 0.638272343099} H1 3624 -1 8 {} O 0.0 {0.413337254885 0.356203436366 0.648701133245} O3 3625 -1 1 {} H 0.0 {0.405997660843 0.363667387997 0.647919899538} H2 3626 -1 8 {} O 0.0 {0.398033693836 0.349662061946 0.623696485973} O4 3627 -1 1 {} H 0.0 {0.395520055759 0.341964274502 0.617010796668} H3 3628 -1 8 {} O 0.0 {0.449132797326 0.357129894052 0.636472072001} O5 3629 -1 1 {} H 0.0 {0.451000649214 0.347699568814 0.640691055823} H4 3630 -1 8 {} O 0.0 {0.424007879115 0.369989232975 0.626191686336} O6 3631 -1 1 {} H 0.0 {0.42774288096 0.378239528054 0.620866003844} H5 3632 -1 8 {} O 0.0 {0.442500415098 0.355867205053 0.607192401394} O7 3633 -1 1 {} H 0.0 {0.44490573729 0.365726168491 0.604472193755} H6 3634 -1 14 {} Si 0.0 {0.405805151401 0.351244461463 0.454117905886} Si1 3635 -1 8 {} O 0.0 {0.420276091229 0.353694493365 0.465201515697} O1 3636 -1 14 {} Si 0.0 {0.430543408364 0.367572866962 0.458892056103} Si2 3637 -1 8 {} O 0.0 {0.425870387975 0.383089550259 0.467602152631} O2 3638 -1 1 {} H 0.0 {0.423553717421 0.380903475105 0.477610305289} H1 3639 -1 8 {} O 0.0 {0.448322221755 0.363937876907 0.461948610419} O3 3640 -1 1 {} H 0.0 {0.450765945942 0.354650126963 0.457702250847} H2 3641 -1 8 {} O 0.0 {0.427704916542 0.369576910541 0.440825441123} O4 3642 -1 1 {} H 0.0 {0.428198985617 0.379759162017 0.438325714397} H3 3643 -1 8 {} O 0.0 {0.406093971023 0.363921627036 0.440791672867} O5 3644 -1 1 {} H 0.0 {0.398051825978 0.362282765448 0.434252284164} H4 3645 -1 8 {} O 0.0 {0.39027779091 0.352915286921 0.463842941684} O6 3646 -1 1 {} H 0.0 {0.383605687341 0.345286826262 0.461094194739} H5 3647 -1 8 {} O 0.0 {0.40657902438 0.334451947111 0.446637513527} O7 3648 -1 1 {} H 0.0 {0.397977701672 0.329047447323 0.449304434129} H6 3649 -1 14 {} Si 0.0 {0.505747034296 0.607437910459 0.427426047603} Si1 3650 -1 8 {} O 0.0 {0.509721631202 0.601255825737 0.444357369602} O1 3651 -1 14 {} Si 0.0 {0.496309783435 0.605973666918 0.456119221541} Si2 3652 -1 8 {} O 0.0 {0.50323885743 0.616725338021 0.469361280067} O2 3653 -1 1 {} H 0.0 {0.508915715297 0.610879115222 0.47598959535} H1 3654 -1 8 {} O 0.0 {0.483097013412 0.6150575609 0.447105239269} O3 3655 -1 1 {} H 0.0 {0.475162014178 0.608502018317 0.445019321012} H2 3656 -1 8 {} O 0.0 {0.489207792808 0.590811353231 0.463740005096} O4 3657 -1 1 {} H 0.0 {0.483425643222 0.593480291773 0.472083497481} H3 3658 -1 8 {} O 0.0 {0.509823942911 0.625332231576 0.426285981855} O5 3659 -1 1 {} H 0.0 {0.503754016187 0.629821542059 0.418991563805} H4 3660 -1 8 {} O 0.0 {0.487831384406 0.605033401904 0.42397689732} O6 3661 -1 1 {} H 0.0 {0.484816690164 0.595645756747 0.427550850497} H5 3662 -1 8 {} O 0.0 {0.515687741938 0.598126108964 0.415028225461} O7 3663 -1 1 {} H 0.0 {0.51056628866 0.589391331809 0.412285950493} H6 3664 -1 14 {} Si 0.0 {0.414391941339 0.572371501897 0.615503459225} Si1 3665 -1 8 {} O 0.0 {0.424845833443 0.583277332138 0.605022666728} O1 3666 -1 14 {} Si 0.0 {0.440066432639 0.574189335512 0.600123384454} Si2 3667 -1 8 {} O 0.0 {0.435756673921 0.556769400689 0.596061481726} O2 3668 -1 1 {} H 0.0 {0.426202816802 0.556463032749 0.591719279733} H1 3669 -1 8 {} O 0.0 {0.447554792546 0.582247522092 0.585376410769} O3 3670 -1 1 {} H 0.0 {0.455426873434 0.588483343416 0.58843094528} H2 3671 -1 8 {} O 0.0 {0.452094824497 0.574443099416 0.614045172946} O4 3672 -1 1 {} H 0.0 {0.447060684796 0.572426727202 0.623040896312} H3 3673 -1 8 {} O 0.0 {0.406303808703 0.559652857673 0.604948054521} O5 3674 -1 1 {} H 0.0 {0.408702508098 0.561436976638 0.594883196314} H4 3675 -1 8 {} O 0.0 {0.401516481952 0.582403105185 0.623896179775} O6 3676 -1 1 {} H 0.0 {0.393818945257 0.57608209453 0.627231927196} H5 3677 -1 8 {} O 0.0 {0.424907107605 0.564110824753 0.628150149674} O7 3678 -1 1 {} H 0.0 {0.421543207796 0.566739621197 0.637738961819} H6 3679 -1 14 {} Si 0.0 {0.535976409461 0.529268146301 0.431873217731} Si1 3680 -1 8 {} O 0.0 {0.544709978016 0.515941980265 0.422620127288} O1 3681 -1 14 {} Si 0.0 {0.532397166225 0.505367742437 0.413900703607} Si2 3682 -1 8 {} O 0.0 {0.53546525605 0.506060561919 0.395768837609} O2 3683 -1 1 {} H 0.0 {0.535377899153 0.516066937788 0.392595277172} H1 3684 -1 8 {} O 0.0 {0.534012733589 0.487977875135 0.419712539418} O3 3685 -1 1 {} H 0.0 {0.54107528486 0.487529804224 0.427465647178} H2 3686 -1 8 {} O 0.0 {0.515412780058 0.511464495978 0.417480883853} O4 3687 -1 1 {} H 0.0 {0.513730426137 0.520388813668 0.412214746507} H3 3688 -1 8 {} O 0.0 {0.518181840518 0.529323056266 0.427258614702} O5 3689 -1 1 {} H 0.0 {0.512684123549 0.524124706451 0.434525759008} H4 3690 -1 8 {} O 0.0 {0.543424953893 0.545565762272 0.427699068511} O6 3691 -1 1 {} H 0.0 {0.545935806558 0.550626405536 0.436554733741} H5 3692 -1 8 {} O 0.0 {0.537599912963 0.526259520552 0.449952172797} O7 3693 -1 1 {} H 0.0 {0.534200290807 0.534693370668 0.455206473604} H6 3694 -1 14 {} Si 0.0 {0.695042967001 0.526599368677 0.630061259078} Si1 3695 -1 8 {} O 0.0 {0.702105667508 0.518389736537 0.615143967369} O1 3696 -1 8 {} O 0.0 {0.704399805227 0.49435444302 0.633048493203} O2 3697 -1 8 {} O 0.0 {0.716746272545 0.493932905005 0.60565174177} O3 3698 -1 8 {} O 0.0 {0.68575250649 0.514321186819 0.640093502966} O6 3699 -1 1 {} H 0.0 {0.677234738414 0.518922893645 0.64419051162} H5 3700 -1 8 {} O 0.0 {0.683660242905 0.539927292774 0.62480752602} O7 3701 -1 1 {} H 0.0 {0.67697559525 0.542069416289 0.632611111311} H6 3702 -1 8 {} O 0.0 {0.686230472286 0.468425428939 0.630185431094} O3 3703 -1 1 {} H 0.0 {0.679318895896 0.461152644527 0.627115842169} H2 3704 -1 14 {} Si 0.0 {0.344575764661 0.327904588753 0.4699394346} Si1 3705 -1 8 {} O 0.0 {0.342670406435 0.326124414984 0.451700517621} O1 3706 -1 14 {} Si 0.0 {0.349394641869 0.340973518791 0.443142773479} Si2 3707 -1 8 {} O 0.0 {0.354692593237 0.353466922425 0.455564875942} O2 3708 -1 1 {} H 0.0 {0.353404135179 0.363106225286 0.451581751128} H1 3709 -1 8 {} O 0.0 {0.3638129003 0.336050285272 0.432853464541} O3 3710 -1 1 {} H 0.0 {0.363076651807 0.325843947994 0.430500614914} H2 3711 -1 8 {} O 0.0 {0.336376998538 0.34820202201 0.43233743421} O4 3712 -1 1 {} H 0.0 {0.333520643584 0.34113095686 0.425115992117} H3 3713 -1 8 {} O 0.0 {0.333606760722 0.315781981603 0.478342057434} O5 3714 -1 1 {} H 0.0 {0.334305325754 0.306497742233 0.473478876979} H4 3715 -1 8 {} O 0.0 {0.339922652942 0.344954631547 0.475062251338} O6 3716 -1 1 {} H 0.0 {0.347312558243 0.351699874611 0.471899359004} H5 3717 -1 8 {} O 0.0 {0.362047034397 0.324627108795 0.474685410598} O7 3718 -1 1 {} H 0.0 {0.368414080772 0.330693179188 0.468967483876} H6 3719 -1 14 {} Si 0.0 {0.359329819525 0.472064841154 0.445450992162} Si1 3720 -1 8 {} O 0.0 {0.357933728111 0.474018289923 0.427204890627} O1 3721 -1 14 {} Si 0.0 {0.350489489566 0.458802797127 0.420138163917} Si2 3722 -1 8 {} O 0.0 {0.361148259785 0.444450911685 0.424323493057} O2 3723 -1 1 {} H 0.0 {0.365342260667 0.445905455073 0.433849158072} H1 3724 -1 8 {} O 0.0 {0.333717653983 0.456269002021 0.427265813768} O3 3725 -1 1 {} H 0.0 {0.332231380709 0.462982922037 0.435192096923} H2 3726 -1 8 {} O 0.0 {0.349216407381 0.460483358424 0.401886617439} O4 3727 -1 1 {} H 0.0 {0.357532792567 0.465761652196 0.398275599107} H3 3728 -1 8 {} O 0.0 {0.376742947789 0.474933399222 0.450602850874} O5 3729 -1 1 {} H 0.0 {0.377101105425 0.476488503339 0.460964967695} H4 3730 -1 8 {} O 0.0 {0.354275114587 0.455010510402 0.450154529} O6 3731 -1 1 {} H 0.0 {0.344053097149 0.453715509847 0.448120194277} H5 3732 -1 8 {} O 0.0 {0.348351883595 0.484240827488 0.453829856442} O7 3733 -1 1 {} H 0.0 {0.33972298383 0.479355467722 0.457296979038} H6 3734 -1 8 {} O 0.0 {0.717927089327 0.422949419126 0.562145885872} O1 3735 -1 14 {} Si 0.0 {0.707208377828 0.414665381413 0.574690763199} Si2 3736 -1 8 {} O 0.0 {0.704734304968 0.425954669437 0.588973193067} O3 3737 -1 1 {} H 0.0 {0.694576907764 0.426095407834 0.591586163209} H2 3738 -1 8 {} O 0.0 {0.690882036356 0.410740129551 0.567135043114} O4 3739 -1 1 {} H 0.0 {0.692357781746 0.40643914368 0.557670374933} H3 3740 -1 14 {} Si 0.0 {0.330926011563 0.490908357635 0.428021792231} Si1 3741 -1 8 {} O 0.0 {0.334443009822 0.497680152219 0.411333165116} O1 3742 -1 14 {} Si 0.0 {0.32082695389 0.509043047433 0.406621186555} Si2 3743 -1 8 {} O 0.0 {0.327581394898 0.525906971704 0.403853940238} O2 3744 -1 1 {} H 0.0 {0.330384288328 0.530093675717 0.413069168749} H1 3745 -1 8 {} O 0.0 {0.312797751227 0.502986103097 0.391244880598} O3 3746 -1 1 {} H 0.0 {0.304097588257 0.497654283909 0.393725870177} H2 3747 -1 8 {} O 0.0 {0.308414370696 0.509559031144 0.42019444741} O4 3748 -1 1 {} H 0.0 {0.310406171852 0.517765924858 0.426425263847} H3 3749 -1 8 {} O 0.0 {0.316029891982 0.48014701576 0.427201546025} O5 3750 -1 1 {} H 0.0 {0.316203449701 0.473343801515 0.435180320223} H4 3751 -1 8 {} O 0.0 {0.327872903062 0.504764959714 0.439697340035} O6 3752 -1 1 {} H 0.0 {0.335757288641 0.505267509688 0.446619304534} H5 3753 -1 8 {} O 0.0 {0.345274169069 0.481129176492 0.433878340226} O7 3754 -1 1 {} H 0.0 {0.353378418467 0.487580890417 0.435668447362} H6 3755 -1 14 {} Si 0.0 {0.483017576875 0.6550950931 0.551636180383} Si1 3756 -1 8 {} O 0.0 {0.467959224702 0.652653435024 0.541411524997} O1 3757 -1 14 {} Si 0.0 {0.471869535743 0.640678407788 0.528119816082} Si2 3758 -1 8 {} O 0.0 {0.487568518175 0.645730199861 0.520067474515} O2 3759 -1 1 {} H 0.0 {0.4930987006 0.65171986374 0.526711740479} H1 3760 -1 8 {} O 0.0 {0.473839301385 0.62387482908 0.535381209645} O3 3761 -1 1 {} H 0.0 {0.465168763287 0.621341645804 0.540734146086} H2 3762 -1 8 {} O 0.0 {0.458306166208 0.640496854279 0.515695065124} O4 3763 -1 1 {} H 0.0 {0.460077169412 0.647905047521 0.508487875965} H3 3764 -1 8 {} O 0.0 {0.490928287256 0.671095049557 0.547207508706} O5 3765 -1 1 {} H 0.0 {0.501004895002 0.670915876935 0.550123751506} H4 3766 -1 8 {} O 0.0 {0.494818334492 0.641400778835 0.548330045459} O6 3767 -1 1 {} H 0.0 {0.498059411653 0.637328867354 0.55742788061} H5 3768 -1 8 {} O 0.0 {0.478471232843 0.655122429469 0.569477089345} O7 3769 -1 1 {} H 0.0 {0.482356154342 0.646515372923 0.57408620088} H6 3770 -1 14 {} Si 0.0 {0.667003972408 0.323216314621 0.543520965461} Si2 3771 -1 8 {} O 0.0 {0.655151998915 0.334447848177 0.55197373494} O2 3772 -1 1 {} H 0.0 {0.654546137862 0.331843470241 0.562145522314} H1 3773 -1 8 {} O 0.0 {0.681250632926 0.332985417791 0.537171180258} O3 3774 -1 8 {} O 0.0 {0.658527385786 0.314793655477 0.529505112266} O4 3775 -1 1 {} H 0.0 {0.656307309498 0.30488371974 0.532202409253} H3 3776 -1 8 {} O 0.0 {0.643597885091 0.305573059266 0.555935700431} O5 3777 -1 1 {} H 0.0 {0.646338952687 0.305604116798 0.545808022965} H4 3778 -1 8 {} O 0.0 {0.656795747367 0.318142650825 0.579738070087} O6 3779 -1 1 {} H 0.0 {0.650176589283 0.314359967814 0.586948898507} H5 3780 -1 14 {} Si 0.0 {0.603809966723 0.612733344631 0.635652228473} Si1 3781 -1 8 {} O 0.0 {0.594716578841 0.598434705734 0.628520708481} O1 3782 -1 14 {} Si 0.0 {0.598520628485 0.597188006812 0.610567758214} Si2 3783 -1 8 {} O 0.0 {0.58407310277 0.603001460315 0.600835059557} O2 3784 -1 1 {} H 0.0 {0.584463314934 0.598871599508 0.591192365901} H1 3785 -1 8 {} O 0.0 {0.613127162648 0.607653725074 0.606659232328} O3 3786 -1 1 {} H 0.0 {0.618228097206 0.603585797931 0.598438857349} H2 3787 -1 8 {} O 0.0 {0.602165893548 0.579684078917 0.606254913713} O4 3788 -1 1 {} H 0.0 {0.607170943671 0.579340217796 0.597033141997} H3 3789 -1 8 {} O 0.0 {0.604115692537 0.611294977347 0.653988467881} O5 3790 -1 1 {} H 0.0 {0.613973142321 0.609595754828 0.657182783339} H4 3791 -1 8 {} O 0.0 {0.595376592121 0.628370390074 0.630858095196} O6 3792 -1 1 {} H 0.0 {0.602233814588 0.634689731878 0.626030478666} H5 3793 -1 8 {} O 0.0 {0.621040293286 0.612831984294 0.629221830706} O7 3794 -1 1 {} H 0.0 {0.623118940126 0.622197916845 0.624966323883} H6 3795 -1 14 {} Si 0.0 {0.416517272612 0.638337357107 0.355721225408} Si1 3796 -1 8 {} O 0.0 {0.423973206468 0.65499014795 0.353274366347} O1 3797 -1 14 {} Si 0.0 {0.439581730097 0.656131525622 0.362973321666} Si2 3798 -1 8 {} O 0.0 {0.435641960629 0.65972544868 0.380588745383} O2 3799 -1 1 {} H 0.0 {0.426490047773 0.655239946737 0.383104162397} H1 3800 -1 8 {} O 0.0 {0.448636939535 0.640160666001 0.361867185341} O3 3801 -1 1 {} H 0.0 {0.452611120047 0.639073932613 0.352211855597} H2 3802 -1 8 {} O 0.0 {0.450090896959 0.669613910267 0.356180622435} O4 3803 -1 1 {} H 0.0 {0.455138194514 0.674397300676 0.364047844391} H3 3804 -1 8 {} O 0.0 {0.427846431682 0.628044428373 0.365910135295} O5 3805 -1 1 {} H 0.0 {0.422719875546 0.619547364025 0.369305808957} H4 3806 -1 8 {} O 0.0 {0.413910013267 0.63022941899 0.339402096432} O6 3807 -1 1 {} H 0.0 {0.404488384051 0.632942660116 0.335624071797} H5 3808 -1 8 {} O 0.0 {0.400358604661 0.640054821057 0.36433316002} O7 3809 -1 1 {} H 0.0 {0.392649007357 0.636914746564 0.357928304731} H6 3810 -1 14 {} Si 0.0 {0.626704406853 0.631167628133 0.582007761925} Si1 3811 -1 8 {} O 0.0 {0.623851765235 0.620631752611 0.567146794139} O1 3812 -1 14 {} Si 0.0 {0.623150144447 0.631333641085 0.552176342089} Si2 3813 -1 8 {} O 0.0 {0.629227433064 0.648155323498 0.556460625298} O2 3814 -1 1 {} H 0.0 {0.622945547003 0.655341354122 0.552111126104} H1 3815 -1 8 {} O 0.0 {0.633735942766 0.624210484319 0.538888128641} O3 3816 -1 1 {} H 0.0 {0.637502096388 0.614930213639 0.542000026903} H2 3817 -1 8 {} O 0.0 {0.605777657253 0.63241386753 0.546235285944} O4 3818 -1 1 {} H 0.0 {0.600115168049 0.638053084108 0.55303348533} H3 3819 -1 8 {} O 0.0 {0.631752793381 0.648015490353 0.576673232475} O5 3820 -1 1 {} H 0.0 {0.628931598989 0.654974762807 0.584012324359} H4 3821 -1 8 {} O 0.0 {0.639993833057 0.623756507656 0.592334093779} O6 3822 -1 1 {} H 0.0 {0.635705660985 0.61908031662 0.600699784003} H5 3823 -1 8 {} O 0.0 {0.611233812119 0.632332929587 0.591890283403} O7 3824 -1 1 {} H 0.0 {0.613363245315 0.636628687091 0.601222871371} H6 3825 -1 14 {} Si 0.0 {0.51149073085 0.429681273445 0.726380150094} Si1 3826 -1 8 {} O 0.0 {0.495374448194 0.435862920201 0.720120073731} O1 3827 -1 14 {} Si 0.0 {0.481841488162 0.427261439043 0.729069268197} Si2 3828 -1 8 {} O 0.0 {0.468592568991 0.42261493681 0.717196788718} O2 3829 -1 1 {} H 0.0 {0.461696093791 0.430481324123 0.716418858634} H1 3830 -1 8 {} O 0.0 {0.52070049386 0.421597215293 0.712671900186} O5 3831 -1 1 {} H 0.0 {0.530774884829 0.420535772251 0.715397534151} H4 3832 -1 8 {} O 0.0 {0.52133509212 0.443753260426 0.732962825691} O7 3833 -1 14 {} Si 0.0 {0.412364956752 0.613435131884 0.574985261816} Si1 3834 -1 8 {} O 0.0 {0.418501011767 0.628351839204 0.58379358022} O1 3835 -1 14 {} Si 0.0 {0.430554416625 0.623268440595 0.596669095506} Si2 3836 -1 8 {} O 0.0 {0.44754986524 0.628147334324 0.591494141593} O2 3837 -1 1 {} H 0.0 {0.451542103976 0.620767069506 0.585175254928} H1 3838 -1 8 {} O 0.0 {0.426374799512 0.631516681223 0.612562414498} O3 3839 -1 1 {} H 0.0 {0.419104756964 0.6258708561 0.617610340171} H2 3840 -1 8 {} O 0.0 {0.429824721688 0.605004661693 0.598874896805} O4 3841 -1 1 {} H 0.0 {0.428564313322 0.600404287192 0.589523410544} H3 3842 -1 8 {} O 0.0 {0.405748204271 0.601441783766 0.587195058984} O5 3843 -1 1 {} H 0.0 {0.400394956524 0.606625140067 0.594575320805} H4 3844 -1 8 {} O 0.0 {0.426216027105 0.605682546004 0.565615503512} O6 3845 -1 1 {} H 0.0 {0.425600693943 0.595232591633 0.566469038902} H5 3846 -1 8 {} O 0.0 {0.398978537681 0.6183361997 0.563285118393} O7 3847 -1 1 {} H 0.0 {0.402842608779 0.618842999695 0.553513911626} H6 3848 -1 14 {} Si 0.0 {0.411364169162 0.683815688491 0.392620789384} Si1 3849 -1 8 {} O 0.0 {0.405781997934 0.67296898838 0.406407939689} O1 3850 -1 14 {} Si 0.0 {0.410559275587 0.680466592329 0.42252848369} Si2 3851 -1 8 {} O 0.0 {0.423701864327 0.693052121558 0.419850203528} O2 3852 -1 1 {} H 0.0 {0.431846941031 0.688601989001 0.41496796491} H1 3853 -1 8 {} O 0.0 {0.39590198531 0.688501107959 0.430122365625} O3 3854 -1 1 {} H 0.0 {0.397273056321 0.689178765126 0.440508177914} H2 3855 -1 8 {} O 0.0 {0.416818749914 0.667317621249 0.433766610655} O4 3856 -1 1 {} H 0.0 {0.424756025368 0.662259981856 0.429130850292} H3 3857 -1 8 {} O 0.0 {0.419002923421 0.699087298362 0.399470969024} O5 3858 -1 1 {} H 0.0 {0.428289048239 0.700721394062 0.394836790825} H4 3859 -1 1 {} H 0.0 {0.389971766658 0.68044935848 0.382223682868} H5 3860 -1 8 {} O 0.0 {0.423737232151 0.674836853039 0.382396533789} O7 3861 -1 1 {} H 0.0 {0.41890916791 0.670348260104 0.374223798824} H6 3862 -1 14 {} Si 0.0 {0.581517439444 0.278062243968 0.588430359242} Si2 3863 -1 8 {} O 0.0 {0.563823107045 0.275080813751 0.584384499582} O2 3864 -1 1 {} H 0.0 {0.561124798052 0.265405170893 0.587437789888} H1 3865 -1 8 {} O 0.0 {0.586281033652 0.294992302553 0.583037009315} O3 3866 -1 1 {} H 0.0 {0.596722865557 0.295990371986 0.583479642241} H2 3867 -1 8 {} O 0.0 {0.654566072758 0.577853156136 0.648005971966} O2 3868 -1 1 {} H 0.0 {0.644083614379 0.577886930693 0.648105940258} H1 3869 -1 1 {} H 0.0 {0.641677096762 0.582968855307 0.673487914443} H3 3870 -1 14 {} Si 0.0 {0.51671679515 0.350359226377 0.59811977937} Si1 3871 -1 8 {} O 0.0 {0.517278520349 0.364184710919 0.586015937622} O1 3872 -1 14 {} Si 0.0 {0.519511179943 0.357285595981 0.569128990323} Si2 3873 -1 8 {} O 0.0 {0.536000855036 0.349218213517 0.567974687529} O2 3874 -1 1 {} H 0.0 {0.541118367837 0.350434182454 0.577067191123} H1 3875 -1 8 {} O 0.0 {0.506352487047 0.344863627853 0.565821438748} O3 3876 -1 1 {} H 0.0 {0.497057708574 0.348760723614 0.568773671205} H2 3877 -1 8 {} O 0.0 {0.518416012796 0.370840900869 0.55674187138} O4 3878 -1 1 {} H 0.0 {0.528085052898 0.374119621011 0.554299788215} H3 3879 -1 8 {} O 0.0 {0.52848509123 0.337203440518 0.592925528289} O5 3880 -1 1 {} H 0.0 {0.537961101788 0.339195775068 0.596981969154} H4 3881 -1 8 {} O 0.0 {0.499682892781 0.343450291777 0.598727563799} O6 3882 -1 1 {} H 0.0 {0.495274731486 0.345849973323 0.607942987921} H5 3883 -1 8 {} O 0.0 {0.521422729317 0.356572502743 0.614781808196} O7 3884 -1 1 {} H 0.0 {0.519544736354 0.349118634463 0.621934382365} H6 3885 -1 14 {} Si 0.0 {0.437162029012 0.517889206907 0.258600008473} Si1 3886 -1 8 {} O 0.0 {0.427496259284 0.533548513833 0.25844564706} O5 3887 -1 1 {} H 0.0 {0.418572147627 0.532192510587 0.263803252294} H4 3888 -1 8 {} O 0.0 {0.454736112696 0.521584547721 0.262619764391} O6 3889 -1 1 {} H 0.0 {0.460940447173 0.517574770909 0.255160387857} H5 3890 -1 8 {} O 0.0 {0.430240909894 0.506520343603 0.271285524566} O7 3891 -1 1 {} H 0.0 {0.438107352003 0.501895458397 0.276476037938} H6 3892 -1 8 {} O 0.0 {0.643153892295 0.56882720824 0.316812940939} O3 3893 -1 1 {} H 0.0 {0.642689434517 0.576378592621 0.32408506213} H2 3894 -1 14 {} Si 0.0 {0.513806321828 0.639469531808 0.306025866558} Si1 3895 -1 8 {} O 0.0 {0.511231314251 0.639848354916 0.324236953108} O1 3896 -1 14 {} Si 0.0 {0.526414713643 0.633973903247 0.332842079721} Si2 3897 -1 8 {} O 0.0 {0.538852935481 0.647497024402 0.333321638212} O2 3898 -1 1 {} H 0.0 {0.533927576436 0.656761569849 0.333526513387} H1 3899 -1 8 {} O 0.0 {0.522088225761 0.629127700047 0.350003729696} O3 3900 -1 1 {} H 0.0 {0.512729355448 0.633165482438 0.352486884562} H2 3901 -1 8 {} O 0.0 {0.533414344554 0.619459168361 0.323930069112} O4 3902 -1 1 {} H 0.0 {0.53288721136 0.621118383515 0.313585255439} H3 3903 -1 8 {} O 0.0 {0.531504680777 0.636111073978 0.302357236141} O5 3904 -1 1 {} H 0.0 {0.532346353943 0.626889713396 0.297411693482} H4 3905 -1 8 {} O 0.0 {0.503384948778 0.626230516754 0.298634423691} O7 3906 -1 1 {} H 0.0 {0.493880763054 0.630111345373 0.296416462515} H6 3907 -1 14 {} Si 0.0 {0.459646974265 0.427001368663 0.590707193711} Si1 3908 -1 8 {} O 0.0 {0.461752918782 0.430574306631 0.572749382975} O1 3909 -1 14 {} Si 0.0 {0.454420591146 0.41697105133 0.562725311969} Si2 3910 -1 8 {} O 0.0 {0.456621623417 0.400941448564 0.571497319114} O2 3911 -1 1 {} H 0.0 {0.466224119169 0.397179027833 0.569531885995} H1 3912 -1 8 {} O 0.0 {0.436475399007 0.420179709699 0.560219720156} O3 3913 -1 1 {} H 0.0 {0.434595897563 0.430458710623 0.561251631742} H2 3914 -1 8 {} O 0.0 {0.462840003242 0.416227313451 0.546369452561} O4 3915 -1 1 {} H 0.0 {0.465165696694 0.406249121219 0.54408170028} H3 3916 -1 8 {} O 0.0 {0.455881195153 0.442645879992 0.599628055932} O5 3917 -1 1 {} H 0.0 {0.446809223146 0.446578626824 0.596091173576} H4 3918 -1 8 {} O 0.0 {0.475192954013 0.419749160055 0.59737978574} O6 3919 -1 1 {} H 0.0 {0.473620771348 0.416626940178 0.607282173118} H5 3920 -1 8 {} O 0.0 {0.445792426762 0.415120251807 0.593107915536} O7 3921 -1 1 {} H 0.0 {0.446865423149 0.407103592435 0.586431154388} H6 3922 -1 14 {} Si 0.0 {0.543555997741 0.515383731484 0.502672800926} Si1 3923 -1 8 {} O 0.0 {0.533142199806 0.519316874102 0.487987859218} O1 3924 -1 14 {} Si 0.0 {0.516421041121 0.511810053732 0.489932276963} Si2 3925 -1 8 {} O 0.0 {0.508286070908 0.510741847213 0.473463202027} O2 3926 -1 1 {} H 0.0 {0.515333458479 0.507711287808 0.466283725851} H1 3927 -1 8 {} O 0.0 {0.517994552393 0.494944862535 0.497035799117} O3 3928 -1 1 {} H 0.0 {0.515986101446 0.495257267484 0.507323479192} H2 3929 -1 8 {} O 0.0 {0.506229255192 0.522238535142 0.50114707196} O4 3930 -1 1 {} H 0.0 {0.499900803678 0.528353764086 0.495424870043} H3 3931 -1 8 {} O 0.0 {0.544287531572 0.497153180588 0.505056278232} O5 3932 -1 1 {} H 0.0 {0.549042781808 0.495018018836 0.514177472801} H4 3933 -1 8 {} O 0.0 {0.536320597225 0.523305283209 0.517633247393} O6 3934 -1 1 {} H 0.0 {0.534310781474 0.533419474546 0.515600107172} H5 3935 -1 8 {} O 0.0 {0.560573270264 0.52179801413 0.499977670983} O7 3936 -1 1 {} H 0.0 {0.560617479555 0.532194498725 0.501280050752} H6 3937 -1 14 {} Si 0.0 {0.558962583614 0.546440576353 0.29692642381} Si1 3938 -1 8 {} O 0.0 {0.547872031931 0.561156090581 0.296477577691} O1 3939 -1 14 {} Si 0.0 {0.540318287015 0.562942403525 0.27973554968} Si2 3940 -1 8 {} O 0.0 {0.538110727247 0.546350419102 0.272059760235} O2 3941 -1 1 {} H 0.0 {0.546555817981 0.540447011447 0.273992363179} H1 3942 -1 8 {} O 0.0 {0.52392906169 0.57113960003 0.281328948151} O3 3943 -1 1 {} H 0.0 {0.522901887298 0.57501669948 0.291034343677} H2 3944 -1 8 {} O 0.0 {0.551262957823 0.57324348742 0.269102199534} O4 3945 -1 1 {} H 0.0 {0.560379565967 0.568271702859 0.267611967741} H3 3946 -1 8 {} O 0.0 {0.573382612252 0.549242553743 0.285840370972} O5 3947 -1 1 {} H 0.0 {0.57989378377 0.556189654779 0.290279181859} H4 3948 -1 8 {} O 0.0 {0.549708247551 0.5315521857 0.291335286622} O6 3949 -1 1 {} H 0.0 {0.54268343733 0.528861244322 0.298663359207} H5 3950 -1 8 {} O 0.0 {0.564917433766 0.543822723232 0.314151511734} O7 3951 -1 1 {} H 0.0 {0.556750612802 0.541597008165 0.320372920683} H6 3952 -1 1 {} H 0.0 {0.558427073258 0.421357395548 0.719764836681} H2 3953 -1 8 {} O 0.0 {0.543945845301 0.395284846661 0.720672511063} O4 3954 -1 14 {} Si 0.0 {0.439758958835 0.531624000778 0.621334781177} Si1 3955 -1 8 {} O 0.0 {0.4239140781 0.525097855541 0.614752929414} O1 3956 -1 14 {} Si 0.0 {0.413773805038 0.539249852711 0.60897513822} Si2 3957 -1 8 {} O 0.0 {0.422466335853 0.554882135114 0.61307098685} O2 3958 -1 1 {} H 0.0 {0.432329792038 0.55271337523 0.615951098001} H1 3959 -1 8 {} O 0.0 {0.411481067073 0.538188225052 0.590773608723} O3 3960 -1 1 {} H 0.0 {0.420774542575 0.539155411598 0.586017423268} H2 3961 -1 8 {} O 0.0 {0.397382562541 0.538916589298 0.617333745073} O4 3962 -1 1 {} H 0.0 {0.393891830571 0.548741706232 0.618555645229} H3 3963 -1 8 {} O 0.0 {0.43670912519 0.539914416251 0.637479377438} O5 3964 -1 1 {} H 0.0 {0.43371672441 0.532770334576 0.64456120803} H4 3965 -1 8 {} O 0.0 {0.446682294528 0.543819757847 0.609417689083} O6 3966 -1 1 {} H 0.0 {0.456638427659 0.541341640355 0.607270127238} H5 3967 -1 8 {} O 0.0 {0.451673681717 0.517804664927 0.623647865574} O7 3968 -1 1 {} H 0.0 {0.446954975799 0.508713916651 0.621360472942} H6 3969 -1 14 {} Si 0.0 {0.536179571911 0.435303009373 0.60163475663} Si1 3970 -1 8 {} O 0.0 {0.537647940065 0.43098092226 0.619442298189} O1 3971 -1 14 {} Si 0.0 {0.552961765763 0.438472676858 0.626348656836} Si2 3972 -1 8 {} O 0.0 {0.567690751185 0.430994946597 0.618257030731} O2 3973 -1 1 {} H 0.0 {0.565543961549 0.421071249723 0.615601949004} H1 3974 -1 8 {} O 0.0 {0.552847630359 0.456626757702 0.623340934243} O3 3975 -1 1 {} H 0.0 {0.545611634918 0.461134502354 0.629473520803} H2 3976 -1 8 {} O 0.0 {0.55364616047 0.435276852249 0.644393926102} O4 3977 -1 1 {} H 0.0 {0.560395949107 0.427473715902 0.646310270458} H3 3978 -1 8 {} O 0.0 {0.52356174845 0.448501684849 0.599525540983} O5 3979 -1 1 {} H 0.0 {0.523029352905 0.451252120153 0.589428548626} H4 3980 -1 8 {} O 0.0 {0.531110442844 0.420401509022 0.59213737155} O6 3981 -1 1 {} H 0.0 {0.539153221058 0.413675043459 0.591665137138} H5 3982 -1 8 {} O 0.0 {0.552396834634 0.441320164312 0.595420515583} O7 3983 -1 1 {} H 0.0 {0.552631675984 0.440496345751 0.584961810925} H6 3984 -1 14 {} Si 0.0 {0.419127930244 0.682975746701 0.580875222572} Si1 3985 -1 8 {} O 0.0 {0.414065746066 0.700115033765 0.584628041309} O1 3986 -1 14 {} Si 0.0 {0.409761643569 0.708181463732 0.568707329} Si2 3987 -1 8 {} O 0.0 {0.396114528356 0.698781459704 0.560689720516} O2 3988 -1 1 {} H 0.0 {0.395994378116 0.68894212229 0.564404643537} H1 3989 -1 8 {} O 0.0 {0.4245518346 0.708128175875 0.557690084625} O4 3990 -1 1 {} H 0.0 {0.432552669741 0.703425515823 0.562578924917} H3 3991 -1 8 {} O 0.0 {0.408685171921 0.671097721732 0.590294775255} O5 3992 -1 1 {} H 0.0 {0.400787245383 0.676253617843 0.59486417111} H4 3993 -1 8 {} O 0.0 {0.436816002757 0.680570490825 0.585300125688} O6 3994 -1 1 {} H 0.0 {0.440535552116 0.672067189508 0.580365895137} H5 3995 -1 8 {} O 0.0 {0.416896392647 0.680244654725 0.562914639166} O7 3996 -1 1 {} H 0.0 {0.423013517712 0.686910884599 0.557568356371} H6 3997 -1 14 {} Si 0.0 {0.492513871438 0.315295633164 0.524571408356} Si1 3998 -1 8 {} O 0.0 {0.501519764626 0.310032863525 0.539708203095} O1 3999 -1 14 {} Si 0.0 {0.493345316054 0.317404777146 0.554427814273} Si2 4000 -1 8 {} O 0.0 {0.476225856858 0.310826485481 0.555823229392} O2 4001 -1 1 {} H 0.0 {0.47329771668 0.30673683645 0.546602000509} H1 4002 -1 8 {} O 0.0 {0.502856896796 0.313072763813 0.569565466687} O3 4003 -1 1 {} H 0.0 {0.511008270186 0.306999617972 0.566947745607} H2 4004 -1 8 {} O 0.0 {0.492761172294 0.335699030482 0.552557316516} O4 4005 -1 1 {} H 0.0 {0.484475800042 0.339473372276 0.557781662716} H3 4006 -1 8 {} O 0.0 {0.502712539763 0.311568225527 0.509747503295} O5 4007 -1 1 {} H 0.0 {0.49865074169 0.303310809635 0.504704458757} H4 4008 -1 8 {} O 0.0 {0.489236005728 0.333384099884 0.525383523594} O6 4009 -1 1 {} H 0.0 {0.497282451946 0.338585670961 0.521091847325} H5 4010 -1 8 {} O 0.0 {0.476559372743 0.30621754591 0.523463905396} O7 4011 -1 1 {} H 0.0 {0.468903743236 0.312929464142 0.520908892887} H6 4012 -1 14 {} Si 0.0 {0.494834836467 0.569994702969 0.702128171696} Si1 4013 -1 8 {} O 0.0 {0.500019609476 0.553946693909 0.694749112149} O1 4014 -1 14 {} Si 0.0 {0.503747016583 0.556249972629 0.676870787986} Si2 4015 -1 8 {} O 0.0 {0.508887239096 0.573658858436 0.673810407402} O2 4016 -1 1 {} H 0.0 {0.509509732739 0.578773816826 0.682951680479} H1 4017 -1 8 {} O 0.0 {0.517338617918 0.544884222931 0.67193512179} O3 4018 -1 1 {} H 0.0 {0.514429030038 0.534970015479 0.673779048489} H2 4019 -1 8 {} O 0.0 {0.48875279471 0.552473781126 0.666943125102} O4 4020 -1 1 {} H 0.0 {0.487990593359 0.559348757774 0.659054920403} H3 4021 -1 8 {} O 0.0 {0.480134003628 0.567317526237 0.712853163648} O5 4022 -1 1 {} H 0.0 {0.482669309668 0.560794678154 0.720677244274} H4 4023 -1 8 {} O 0.0 {0.490563950429 0.581867230517 0.688738109232} O6 4024 -1 1 {} H 0.0 {0.487196521255 0.590861794678 0.692997785393} H5 4025 -1 8 {} O 0.0 {0.508613275023 0.576834944646 0.712216189898} O7 4026 -1 1 {} H 0.0 {0.509770789321 0.587045272862 0.710066994853} H6 4027 -1 14 {} Si 0.0 {0.369288039845 0.320821373602 0.59312742676} Si1 4028 -1 8 {} O 0.0 {0.35363201071 0.301449173501 0.574357389247} O3 4029 -1 1 {} H 0.0 {0.35937811964 0.296907618705 0.566834618432} H2 4030 -1 8 {} O 0.0 {0.357480430156 0.324358222013 0.579501162061} O5 4031 -1 1 {} H 0.0 {0.347663634409 0.323480205411 0.583084134716} H4 4032 -1 8 {} O 0.0 {0.386105795923 0.318075315775 0.586154666385} O6 4033 -1 1 {} H 0.0 {0.39192042598 0.326715702688 0.58754082186} H5 4034 -1 8 {} O 0.0 {0.369729778978 0.335121332727 0.604736605167} O7 4035 -1 1 {} H 0.0 {0.375560702263 0.342806416902 0.600601618624} H6 4036 -1 8 {} O 0.0 {0.265966384506 0.449527223986 0.445149084026} O6 4037 -1 1 {} H 0.0 {0.273308807872 0.442322378817 0.443025952646} H5 4038 -1 14 {} Si 0.0 {0.430566145031 0.667663500019 0.565990772781} Si1 4039 -1 8 {} O 0.0 {0.442823034721 0.654569601881 0.561239637493} O1 4040 -1 14 {} Si 0.0 {0.445460479773 0.642542104251 0.575076543083} Si2 4041 -1 8 {} O 0.0 {0.432372902018 0.629547931744 0.574624513313} O2 4042 -1 1 {} H 0.0 {0.436680614654 0.620319405628 0.572113397055} H1 4043 -1 8 {} O 0.0 {0.461897981752 0.634541615326 0.573076305297} O3 4044 -1 1 {} H 0.0 {0.467588608227 0.636050673693 0.581735650473} H2 4045 -1 8 {} O 0.0 {0.444815883814 0.65137065451 0.591215662535} O4 4046 -1 1 {} H 0.0 {0.435457728207 0.649755347415 0.595710375974} H3 4047 -1 8 {} O 0.0 {0.418031026676 0.669597399706 0.552354371179} O5 4048 -1 1 {} H 0.0 {0.421358738329 0.66468092992 0.543722451848} H4 4049 -1 8 {} O 0.0 {0.439322780273 0.683676220085 0.568414855673} O6 4050 -1 1 {} H 0.0 {0.432474078724 0.690942945739 0.571661092868} H5 4051 -1 8 {} O 0.0 {0.4220361768 0.662840404934 0.581589965954} O7 4052 -1 1 {} H 0.0 {0.428881787147 0.663072409647 0.589541413388} H6 4053 -1 14 {} Si 0.0 {0.696521408266 0.431044853244 0.555072587056} Si1 4054 -1 8 {} O 0.0 {0.712311760845 0.425703847445 0.547330717776} O1 4055 -1 14 {} Si 0.0 {0.722902559839 0.440475864497 0.54465859734} Si2 4056 -1 8 {} O 0.0 {0.737898251887 0.435699598877 0.535135259498} O2 4057 -1 8 {} O 0.0 {0.713405841887 0.453095734734 0.535242874937} O3 4058 -1 1 {} H 0.0 {0.71435274145 0.462411620456 0.539971613715} H2 4059 -1 8 {} O 0.0 {0.727911798147 0.447458017333 0.560940045391} O4 4060 -1 8 {} O 0.0 {0.682941142339 0.419875228322 0.549705651085} O5 4061 -1 1 {} H 0.0 {0.673815445534 0.425033771884 0.550151180557} H4 4062 -1 8 {} O 0.0 {0.692754015358 0.448240912028 0.549861080512} O6 4063 -1 1 {} H 0.0 {0.685353802288 0.452232125477 0.556125869546} H5 4064 -1 8 {} O 0.0 {0.698085871972 0.430481526638 0.573377337614} O7 4065 -1 1 {} H 0.0 {0.704817739151 0.437902197479 0.576532775939} H6 4066 -1 8 {} O 0.0 {0.535803234845 0.612844809462 0.285510196619} O3 4067 -1 1 {} H 0.0 {0.526006621299 0.615534294258 0.2828634753} H2 4068 -1 14 {} Si 0.0 {0.620400705983 0.504955291592 0.537946405266} Si1 4069 -1 8 {} O 0.0 {0.614226384826 0.522264776363 0.537215010623} O1 4070 -1 14 {} Si 0.0 {0.595840907075 0.522116698201 0.537158582499} Si2 4071 -1 8 {} O 0.0 {0.589684744599 0.52009427705 0.554379520266} O2 4072 -1 1 {} H 0.0 {0.596285083071 0.513928564664 0.559740312106} H1 4073 -1 8 {} O 0.0 {0.58957392138 0.537958106644 0.530208262487} O3 4074 -1 1 {} H 0.0 {0.595437530367 0.545897355228 0.5337797956} H2 4075 -1 8 {} O 0.0 {0.589884264802 0.508109461256 0.526830481376} O4 4076 -1 1 {} H 0.0 {0.582814510586 0.50255264074 0.532238521859} H3 4077 -1 8 {} O 0.0 {0.606107687536 0.493389550033 0.538598722456} O5 4078 -1 1 {} H 0.0 {0.604852443295 0.488863285655 0.529208319914} H4 4079 -1 8 {} O 0.0 {0.630755717218 0.502760157927 0.552995434234} O6 4080 -1 1 {} H 0.0 {0.640776442728 0.50484925135 0.550670234696} H5 4081 -1 8 {} O 0.0 {0.63048101601 0.501396013337 0.522973098107} O7 4082 -1 1 {} H 0.0 {0.639596494224 0.506561406202 0.523596972426} H6 4083 -1 14 {} Si 0.0 {0.508052696122 0.47888843556 0.6364873083} Si1 4084 -1 8 {} O 0.0 {0.51294776893 0.467505983245 0.650244958717} O1 4085 -1 14 {} Si 0.0 {0.499091362376 0.465675309773 0.662291257377} Si2 4086 -1 8 {} O 0.0 {0.482991536571 0.466836815843 0.653385094569} O2 4087 -1 1 {} H 0.0 {0.481565163219 0.47666054535 0.649978700851} H1 4088 -1 8 {} O 0.0 {0.500284764985 0.44930210641 0.670609736521} O3 4089 -1 1 {} H 0.0 {0.50918942903 0.444562851062 0.667723539995} H2 4090 -1 8 {} O 0.0 {0.500178879639 0.479044600889 0.674924539007} O4 4091 -1 1 {} H 0.0 {0.50896258033 0.477846326029 0.680529088017} H3 4092 -1 8 {} O 0.0 {0.519533386867 0.493262500677 0.636092493888} O5 4093 -1 1 {} H 0.0 {0.520923068675 0.496345476772 0.62615920906} H4 4094 -1 8 {} O 0.0 {0.490826726858 0.48492056509 0.639064084684} O6 4095 -1 1 {} H 0.0 {0.486020586629 0.485826540187 0.629773365989} H5 4096 -1 8 {} O 0.0 {0.508967102336 0.469854614312 0.620492454704} O7 4097 -1 1 {} H 0.0 {0.512378012196 0.47636811188 0.613001725622} H6 4098 -1 14 {} Si 0.0 {0.47763601183 0.644859735104 0.37902447781} Si1 4099 -1 8 {} O 0.0 {0.479713813228 0.658344131929 0.391233559607} O1 4100 -1 14 {} Si 0.0 {0.494642807063 0.654663897923 0.401131686287} Si2 4101 -1 8 {} O 0.0 {0.509112776294 0.662890435816 0.393381742354} O2 4102 -1 1 {} H 0.0 {0.506049859283 0.667909722962 0.384667845675} H1 4103 -1 8 {} O 0.0 {0.492482338833 0.660695243195 0.418473733658} O3 4104 -1 1 {} H 0.0 {0.485707072209 0.654485400837 0.423521320506} H2 4105 -1 8 {} O 0.0 {0.49733062482 0.636468330895 0.401400821104} O4 4106 -1 1 {} H 0.0 {0.505633562594 0.634068808987 0.395502543118} H3 4107 -1 8 {} O 0.0 {0.49020096462 0.631809048232 0.382344393734} O5 4108 -1 1 {} H 0.0 {0.485462154703 0.622485894443 0.383034338375} H4 4109 -1 8 {} O 0.0 {0.480058680729 0.651467756495 0.362032788027} O6 4110 -1 1 {} H 0.0 {0.470716498381 0.653053356855 0.357549431294} H5 4111 -1 8 {} O 0.0 {0.460773445857 0.63774323518 0.380592622862} O7 4112 -1 1 {} H 0.0 {0.460273121177 0.628766947301 0.375204500116} H6 4113 -1 14 {} Si 0.0 {0.707564180177 0.602227628795 0.483964754405} Si1 4114 -1 8 {} O 0.0 {0.696304769977 0.613141985705 0.474334322989} O1 4115 -1 1 {} H 0.0 {0.690886883415 0.631531255345 0.452613270872} H2 4116 -1 8 {} O 0.0 {0.715945317955 0.590469776636 0.472551132795} O6 4117 -1 1 {} H 0.0 {0.720355745934 0.582739900168 0.478123838314} H5 4118 -1 8 {} O 0.0 {0.697781979674 0.592809444874 0.496383972912} O7 4119 -1 1 {} H 0.0 {0.701891547031 0.583218077589 0.497520432686} H6 4120 -1 14 {} Si 0.0 {0.584534350398 0.508264223636 0.333492118458} Si1 4121 -1 8 {} O 0.0 {0.591330497463 0.506945541118 0.31650095056} O1 4122 -1 14 {} Si 0.0 {0.578021468116 0.5109392556 0.30448854664} Si2 4123 -1 8 {} O 0.0 {0.582720823808 0.525893542897 0.294895232} O2 4124 -1 1 {} H 0.0 {0.586726990996 0.533075634775 0.301406478385} H1 4125 -1 8 {} O 0.0 {0.57559891744 0.496767573836 0.293021988703} O3 4126 -1 1 {} H 0.0 {0.566865252383 0.491580308278 0.295690236275} H2 4127 -1 8 {} O 0.0 {0.562391716346 0.514180454172 0.313622019688} O4 4128 -1 1 {} H 0.0 {0.563939414581 0.521943515199 0.320526509591} H3 4129 -1 8 {} O 0.0 {0.589070792395 0.524554262512 0.340625052956} O5 4130 -1 1 {} H 0.0 {0.580377640829 0.530285874791 0.341959037586} H4 4131 -1 8 {} O 0.0 {0.591424266062 0.494823391514 0.343979203842} O6 4132 -1 1 {} H 0.0 {0.592231028102 0.49820929989 0.353884950402} H5 4133 -1 8 {} O 0.0 {0.566213175687 0.506793279119 0.332825726148} O7 4134 -1 1 {} H 0.0 {0.563073259713 0.499286212795 0.339435092072} H6 4135 -1 14 {} Si 0.0 {0.614695365058 0.355186075608 0.455985839418} Si1 4136 -1 8 {} O 0.0 {0.608072468014 0.340405780556 0.46469676147} O1 4137 -1 14 {} Si 0.0 {0.593760939306 0.345225993251 0.475160872765} Si2 4138 -1 8 {} O 0.0 {0.595317469444 0.33712941152 0.491594377955} O2 4139 -1 1 {} H 0.0 {0.604115363163 0.331395223464 0.491824776154} H1 4140 -1 8 {} O 0.0 {0.593507711816 0.363502569123 0.477302591738} O3 4141 -1 1 {} H 0.0 {0.583560574778 0.366883913022 0.477281298297} H2 4142 -1 8 {} O 0.0 {0.578148728807 0.339770282461 0.467074617827} O4 4143 -1 1 {} H 0.0 {0.570332715871 0.339950193944 0.474078433155} H3 4144 -1 8 {} O 0.0 {0.601668978311 0.362278634168 0.445100134431} O5 4145 -1 1 {} H 0.0 {0.594187802851 0.366673273045 0.451011413598} H4 4146 -1 8 {} O 0.0 {0.629137372066 0.350158839448 0.445792028224} O6 4147 -1 1 {} H 0.0 {0.632081453976 0.340440391658 0.448471485242} H5 4148 -1 8 {} O 0.0 {0.619951454458 0.367811215767 0.468318185999} O7 4149 -1 1 {} H 0.0 {0.621030453482 0.363283849951 0.477726147035} H6 4150 -1 8 {} O 0.0 {0.583372521935 0.614402778422 0.298727893537} O2 4151 -1 1 {} H 0.0 {0.588725171783 0.615367524044 0.307717548003} H1 4152 -1 14 {} Si 0.0 {0.489678041461 0.364309352544 0.414803263903} Si1 4153 -1 8 {} O 0.0 {0.495603377348 0.356293335991 0.399355298534} O1 4154 -1 14 {} Si 0.0 {0.495228644805 0.368537428963 0.385650184422} Si2 4155 -1 8 {} O 0.0 {0.483250942173 0.363009025653 0.372828364327} O2 4156 -1 1 {} H 0.0 {0.477725836497 0.354866616177 0.37650151211} H1 4157 -1 8 {} O 0.0 {0.490052087487 0.384921742247 0.392229974735} O3 4158 -1 1 {} H 0.0 {0.497328160181 0.388440815262 0.398936887533} H2 4159 -1 8 {} O 0.0 {0.511996619275 0.36994360915 0.378210574815} O4 4160 -1 1 {} H 0.0 {0.513776900708 0.361648271168 0.372030327021} H3 4161 -1 8 {} O 0.0 {0.481463310147 0.3802484995 0.410667676308} O5 4162 -1 1 {} H 0.0 {0.472294648172 0.378319270926 0.405927871246} H4 4163 -1 8 {} O 0.0 {0.503980238763 0.367494559868 0.425925943707} O6 4164 -1 1 {} H 0.0 {0.507238579253 0.358428440615 0.430095396729} H5 4165 -1 8 {} O 0.0 {0.477665881772 0.353229796502 0.423250986659} O7 4166 -1 1 {} H 0.0 {0.482139722648 0.349116640798 0.431810446005} H6 4167 -1 14 {} Si 0.0 {0.575366064694 0.693327784579 0.40062180411} Si1 4168 -1 8 {} O 0.0 {0.564292061507 0.697469264702 0.414735578129} O1 4169 -1 14 {} Si 0.0 {0.547081226841 0.694374280064 0.409455302499} Si2 4170 -1 8 {} O 0.0 {0.543634950934 0.70474521817 0.39452028184} O2 4171 -1 8 {} O 0.0 {0.545259357073 0.676505691142 0.405231785989} O3 4172 -1 1 {} H 0.0 {0.552441927535 0.670913858457 0.410517129419} H2 4173 -1 8 {} O 0.0 {0.535154638502 0.6987040578 0.423093286591} O4 4174 -1 1 {} H 0.0 {0.536621352146 0.708597576508 0.426327633968} H3 4175 -1 8 {} O 0.0 {0.58502047055 0.678177467756 0.404670431973} O5 4176 -1 1 {} H 0.0 {0.583096380331 0.675371297993 0.414610476139} H4 4177 -1 8 {} O 0.0 {0.565223998091 0.690255259612 0.385548656464} O7 4178 -1 1 {} H 0.0 {0.560415978252 0.699138767763 0.382695786674} H6 4179 -1 14 {} Si 0.0 {0.348945276736 0.540117838683 0.578516464054} Si1 4180 -1 8 {} O 0.0 {0.34103654768 0.542775169034 0.562002745226} O1 4181 -1 14 {} Si 0.0 {0.324848718954 0.53386267735 0.560729458347} Si2 4182 -1 8 {} O 0.0 {0.327604291765 0.515679988436 0.56087368093} O2 4183 -1 1 {} H 0.0 {0.32592387079 0.51182410764 0.551262711914} H1 4184 -1 8 {} O 0.0 {0.313933574228 0.538549202142 0.574788483299} O3 4185 -1 1 {} H 0.0 {0.319434179254 0.544053835584 0.581781570591} H2 4186 -1 8 {} O 0.0 {0.316746829846 0.538517628434 0.544898764627} O4 4187 -1 1 {} H 0.0 {0.320198222613 0.532216767306 0.537238538216} H3 4188 -1 8 {} O 0.0 {0.345312651905 0.523218481919 0.584696819885} O5 4189 -1 1 {} H 0.0 {0.35357531857 0.516999153342 0.582892561685} H4 4190 -1 8 {} O 0.0 {0.342587107066 0.552465292419 0.590506877978} O6 4191 -1 1 {} H 0.0 {0.350363980755 0.559008367581 0.593233153898} H5 4192 -1 8 {} O 0.0 {0.367145716851 0.54218641893 0.576848298098} O7 4193 -1 1 {} H 0.0 {0.369888278717 0.551752922641 0.5802017625} H6 4194 -1 14 {} Si 0.0 {0.635755990817 0.389509693093 0.541357327138} Si1 4195 -1 8 {} O 0.0 {0.629588986911 0.405572872053 0.534730328257} O1 4196 -1 14 {} Si 0.0 {0.634128443154 0.419216731579 0.546231672199} Si2 4197 -1 8 {} O 0.0 {0.623025173831 0.433612469263 0.543340847487} O2 4198 -1 1 {} H 0.0 {0.628026602231 0.440761875467 0.537474170327} H1 4199 -1 8 {} O 0.0 {0.632366977348 0.413485792964 0.563600657784} O3 4200 -1 1 {} H 0.0 {0.622604047603 0.409925009067 0.565111475548} H2 4201 -1 8 {} O 0.0 {0.651536639631 0.424264761437 0.543061058035} O4 4202 -1 1 {} H 0.0 {0.65161332764 0.433243842508 0.537580968247} H3 4203 -1 8 {} O 0.0 {0.653469906713 0.38714498723 0.53673154646} O5 4204 -1 1 {} H 0.0 {0.658554412005 0.396287037201 0.537385961527} H4 4205 -1 8 {} O 0.0 {0.625789008539 0.375821709745 0.534206138804} O6 4206 -1 1 {} H 0.0 {0.621326801657 0.370364728744 0.541947115722} H5 4207 -1 8 {} O 0.0 {0.634087023358 0.38940503784 0.559656226492} O7 4208 -1 1 {} H 0.0 {0.623913478937 0.389007174987 0.562213465489} H6 4209 -1 14 {} Si 0.0 {0.560951067974 0.648279973 0.549866434517} Si1 4210 -1 8 {} O 0.0 {0.548818117904 0.644919919286 0.536129420528} O1 4211 -1 14 {} Si 0.0 {0.531453518255 0.644498763185 0.542782593632} Si2 4212 -1 8 {} O 0.0 {0.52447729346 0.627597233762 0.540629001653} O2 4213 -1 1 {} H 0.0 {0.519861740094 0.626907968758 0.531229488997} H1 4214 -1 8 {} O 0.0 {0.531696898178 0.649069816173 0.560836262039} O3 4215 -1 1 {} H 0.0 {0.540251549713 0.644992002598 0.565470423908} H2 4216 -1 8 {} O 0.0 {0.5210224163 0.656603173653 0.533673455786} O4 4217 -1 1 {} H 0.0 {0.511573241692 0.65240065647 0.531887022267} H3 4218 -1 8 {} O 0.0 {0.557912391431 0.636742984249 0.56388375731} O5 4219 -1 1 {} H 0.0 {0.557331637825 0.642217154362 0.572840774909} H4 4220 -1 8 {} O 0.0 {0.559035838005 0.665506471227 0.555903348916} O6 4221 -1 1 {} H 0.0 {0.568478027606 0.670027361858 0.556596857293} H5 4222 -1 8 {} O 0.0 {0.578086485667 0.64595947622 0.543588502783} O7 4223 -1 1 {} H 0.0 {0.583690648814 0.654655387717 0.54545426464} H6 4224 -1 14 {} Si 0.0 {0.594591342521 0.454960623412 0.494381481092} Si1 4225 -1 8 {} O 0.0 {0.60541442577 0.469973374414 0.494043582933} O1 4226 -1 14 {} Si 0.0 {0.600298188487 0.481308942412 0.480370960506} Si2 4227 -1 8 {} O 0.0 {0.597870363493 0.498258576247 0.487095864044} O2 4228 -1 1 {} H 0.0 {0.594586929009 0.49762293981 0.497042588658} H1 4229 -1 8 {} O 0.0 {0.613383307255 0.481721541895 0.467460125182} O3 4230 -1 1 {} H 0.0 {0.613939218343 0.491393389421 0.463367653044} H2 4231 -1 8 {} O 0.0 {0.584582068792 0.475412023834 0.472904650994} O4 4232 -1 1 {} H 0.0 {0.576514674481 0.480455624627 0.477319400735} H3 4233 -1 8 {} O 0.0 {0.59603851252 0.445967750312 0.478392371283} O5 4234 -1 1 {} H 0.0 {0.60357566125 0.438688681737 0.479152421671} H4 4235 -1 8 {} O 0.0 {0.576905338373 0.459917213937 0.49718614293} O6 4236 -1 1 {} H 0.0 {0.57650661402 0.469115433639 0.502311982041} H5 4237 -1 8 {} O 0.0 {0.599978711679 0.443868565583 0.508111403984} O7 4238 -1 1 {} H 0.0 {0.608405966058 0.447928736221 0.512817343102} H6 4239 -1 14 {} Si 0.0 {0.575476245061 0.447809431784 0.288596791164} Si1 4240 -1 8 {} O 0.0 {0.573653727933 0.429592175346 0.287630215764} O1 4241 -1 14 {} Si 0.0 {0.587626052737 0.421755426409 0.296623067665} Si2 4242 -1 8 {} O 0.0 {0.598963095567 0.434826739407 0.302890741528} O2 4243 -1 1 {} H 0.0 {0.603024518448 0.44011309953 0.294771571655} H1 4244 -1 8 {} O 0.0 {0.581121753101 0.411974941675 0.31078674287} O3 4245 -1 1 {} H 0.0 {0.572475271311 0.416599825003 0.314541696291} H2 4246 -1 8 {} O 0.0 {0.596791740167 0.410695083438 0.285169725973} O4 4247 -1 1 {} H 0.0 {0.604308963576 0.4161844504 0.280303129957} H3 4248 -1 8 {} O 0.0 {0.583045547767 0.452214016138 0.304755075042} O5 4249 -1 1 {} H 0.0 {0.593520882132 0.451821314655 0.303939127032} H4 4250 -1 8 {} O 0.0 {0.55895263892 0.455744867863 0.28711951863} O6 4251 -1 1 {} H 0.0 {0.55696362935 0.457816438924 0.277023884739} H5 4252 -1 8 {} O 0.0 {0.586342899103 0.453621124596 0.274922032879} O7 4253 -1 1 {} H 0.0 {0.58340671019 0.463268722904 0.271998624407} H6 4254 -1 14 {} Si 0.0 {0.679655400807 0.349157462557 0.462900491867} Si1 4255 -1 8 {} O 0.0 {0.665440500345 0.339420328387 0.469252329669} O1 4256 -1 14 {} Si 0.0 {0.661004168999 0.345434071053 0.486056719622} Si2 4257 -1 8 {} O 0.0 {0.67038247191 0.335882968729 0.498692800444} O2 4258 -1 1 {} H 0.0 {0.673493440031 0.326745622053 0.494562204734} H1 4259 -1 8 {} O 0.0 {0.665201081113 0.36328833741 0.487500041287} O3 4260 -1 1 {} H 0.0 {0.656520886822 0.369031287388 0.486099865419} H2 4261 -1 8 {} O 0.0 {0.642982882169 0.343163138388 0.48875412253} O4 4262 -1 1 {} H 0.0 {0.639199862534 0.336594331322 0.481513541888} H3 4263 -1 8 {} O 0.0 {0.69316702094 0.348883709358 0.47523058234} O5 4264 -1 1 {} H 0.0 {0.696378935905 0.358684794705 0.476994163109} H4 4265 -1 8 {} O 0.0 {0.674464048531 0.366559980041 0.460059088688} O6 4266 -1 1 {} H 0.0 {0.682219809048 0.371755430026 0.455242014951} H5 4267 -1 8 {} O 0.0 {0.685584911488 0.341870330467 0.447099263661} O7 4268 -1 1 {} H 0.0 {0.687618945025 0.349576254331 0.440262544844} H6 4269 -1 14 {} Si 0.0 {0.309636555596 0.437420750779 0.407757106391} Si1 4270 -1 8 {} O 0.0 {0.317212679473 0.428445830396 0.393621559233} O1 4271 -1 14 {} Si 0.0 {0.311772988403 0.410893760358 0.394052602705} Si2 4272 -1 8 {} O 0.0 {0.322086807609 0.400963508039 0.382504668054} O2 4273 -1 1 {} H 0.0 {0.331874229886 0.400316934184 0.386250401958} H1 4274 -1 8 {} O 0.0 {0.31365183656 0.404340858028 0.411139359606} O3 4275 -1 1 {} H 0.0 {0.304631939789 0.399920646768 0.41418687787} H2 4276 -1 8 {} O 0.0 {0.294113939293 0.40984424444 0.38899751556} O4 4277 -1 1 {} H 0.0 {0.293137860006 0.402950513362 0.381145734718} H3 4278 -1 8 {} O 0.0 {0.317891797007 0.453726049061 0.409835276874} O5 4279 -1 1 {} H 0.0 {0.311891852079 0.461233103952 0.405606276416} H4 4280 -1 8 {} O 0.0 {0.311706479798 0.427476029465 0.423100069586} O6 4281 -1 1 {} H 0.0 {0.308636830307 0.433148866585 0.431376529838} H5 4282 -1 8 {} O 0.0 {0.291714442141 0.439983345392 0.404477421124} O7 4283 -1 1 {} H 0.0 {0.286325070325 0.438752920883 0.413401649948} H6 4284 -1 1 {} H 0.0 {0.559418279237 0.330794519058 0.669463218421} H2 4285 -1 8 {} O 0.0 {0.540599530327 0.314261873719 0.66575067705} O6 4286 -1 1 {} H 0.0 {0.536475492753 0.323901311785 0.666364361779} H5 4287 -1 14 {} Si 0.0 {0.627057007177 0.66323645651 0.491090279991} Si1 4288 -1 8 {} O 0.0 {0.629708074927 0.68089010769 0.495620980699} O1 4289 -1 14 {} Si 0.0 {0.619779089234 0.685100868784 0.510566188628} Si2 4290 -1 8 {} O 0.0 {0.626537347183 0.676196633955 0.525198892381} O2 4291 -1 1 {} H 0.0 {0.629003577515 0.666366939437 0.522474105983} H1 4292 -1 8 {} O 0.0 {0.620655981981 0.703241124027 0.513512384352} O3 4293 -1 8 {} O 0.0 {0.602231681917 0.680202891052 0.507948621543} O4 4294 -1 1 {} H 0.0 {0.601834643967 0.670235182456 0.504704989168} H3 4295 -1 8 {} O 0.0 {0.628767518583 0.652690163438 0.506070497937} O5 4296 -1 1 {} H 0.0 {0.619631682261 0.652449726954 0.511232192517} H4 4297 -1 8 {} O 0.0 {0.63959805217 0.658201694121 0.478594171022} O6 4298 -1 1 {} H 0.0 {0.637748120028 0.663237451109 0.469565180327} H5 4299 -1 8 {} O 0.0 {0.610205679094 0.66118119915 0.484003855137} O7 4300 -1 1 {} H 0.0 {0.608242695623 0.669056319204 0.47734159725} H6 4301 -1 14 {} Si 0.0 {0.421754331595 0.654399676998 0.558403055628} Si1 4302 -1 8 {} O 0.0 {0.414171091922 0.643114381085 0.546233131299} O1 4303 -1 14 {} Si 0.0 {0.402790971184 0.652551839857 0.535279641717} Si2 4304 -1 8 {} O 0.0 {0.385693249716 0.651453037889 0.541902875819} O2 4305 -1 1 {} H 0.0 {0.386082391999 0.65024651431 0.552312953006} H1 4306 -1 8 {} O 0.0 {0.407989362239 0.670194512714 0.534624139507} O3 4307 -1 1 {} H 0.0 {0.417071384826 0.670968625294 0.529411113749} H2 4308 -1 8 {} O 0.0 {0.403279913795 0.645376118739 0.518351174382} O4 4309 -1 1 {} H 0.0 {0.394481006476 0.639918182749 0.516627054169} H3 4310 -1 8 {} O 0.0 {0.408837306384 0.665670616821 0.565137623459} O5 4311 -1 1 {} H 0.0 {0.40428955623 0.661172590829 0.573462257145} H4 4312 -1 8 {} O 0.0 {0.435139599706 0.664294643846 0.550176434854} O6 4313 -1 1 {} H 0.0 {0.43600410871 0.661406009027 0.540121465348} H5 4314 -1 8 {} O 0.0 {0.428897485804 0.644693882475 0.572151684147} O7 4315 -1 1 {} H 0.0 {0.422536286312 0.645216152218 0.580468230267} H6 4316 -1 14 {} Si 0.0 {0.410137966437 0.59750641689 0.388718037385} Si1 4317 -1 8 {} O 0.0 {0.424175632482 0.60945392498 0.388341325436} O1 4318 -1 14 {} Si 0.0 {0.42585692555 0.617619643483 0.404793503085} Si2 4319 -1 8 {} O 0.0 {0.414078744016 0.609979188628 0.416665752115} O2 4320 -1 1 {} H 0.0 {0.407941784463 0.617437332817 0.420771302575} H1 4321 -1 8 {} O 0.0 {0.443092576012 0.615534797144 0.41102144742} O3 4322 -1 1 {} H 0.0 {0.448068537413 0.624767403961 0.410714574852} H2 4323 -1 8 {} O 0.0 {0.42211489253 0.635547511349 0.403136698364} O4 4324 -1 1 {} H 0.0 {0.418431250922 0.639190067342 0.412265141904} H3 4325 -1 8 {} O 0.0 {0.402353180277 0.597648270135 0.405395125373} O5 4326 -1 1 {} H 0.0 {0.392074028065 0.59956510586 0.404430887307} H4 4327 -1 8 {} O 0.0 {0.416384809033 0.580589376113 0.385008939433} O6 4328 -1 1 {} H 0.0 {0.409772164337 0.575793824487 0.378404361018} H5 4329 -1 8 {} O 0.0 {0.397647784095 0.602314561523 0.376089994322} O7 4330 -1 1 {} H 0.0 {0.400963930558 0.599322363586 0.366586592364} H6 4331 -1 14 {} Si 0.0 {0.44853562979 0.589748382667 0.43926749935} Si1 4332 -1 8 {} O 0.0 {0.433351779067 0.59575759761 0.44779377165} O1 4333 -1 14 {} Si 0.0 {0.426793301594 0.582613573473 0.458892226095} Si2 4334 -1 8 {} O 0.0 {0.431791652202 0.586163107232 0.47624099373} O2 4335 -1 1 {} H 0.0 {0.441765542494 0.583234488065 0.477669893828} H1 4336 -1 8 {} O 0.0 {0.408411517129 0.582325210048 0.4577923382} O3 4337 -1 1 {} H 0.0 {0.405115847947 0.59061287809 0.452268362184} H2 4338 -1 8 {} O 0.0 {0.433558290788 0.566266471598 0.453770067237} O4 4339 -1 1 {} H 0.0 {0.44383687822 0.565911184882 0.455910076257} H3 4340 -1 8 {} O 0.0 {0.45909496309 0.580534528343 0.451184689953} O5 4341 -1 1 {} H 0.0 {0.454142472595 0.5798182 0.460401041348} H4 4342 -1 8 {} O 0.0 {0.457910030706 0.604150188132 0.43266448349} O6 4343 -1 1 {} H 0.0 {0.457066488196 0.604372069803 0.422204366763} H5 4344 -1 8 {} O 0.0 {0.443822750991 0.578602284955 0.425402060652} O7 4345 -1 1 {} H 0.0 {0.433418248739 0.578899179516 0.424060832484} H6 4346 -1 14 {} Si 0.0 {0.592794794368 0.338963536501 0.428938363695} Si1 4347 -1 8 {} O 0.0 {0.610621609913 0.334548274854 0.43005112195} O1 4348 -1 14 {} Si 0.0 {0.612323247061 0.316411500177 0.432662039943} Si2 4349 -1 8 {} O 0.0 {0.596413604288 0.308098098323 0.428601523018} O2 4350 -1 1 {} H 0.0 {0.589122827695 0.310897093925 0.435617529677} H1 4351 -1 8 {} O 0.0 {0.625612500182 0.309877686852 0.421750842546} O3 4352 -1 1 {} H 0.0 {0.629211156596 0.317611667918 0.415626855913} H2 4353 -1 8 {} O 0.0 {0.616654039702 0.313121585158 0.450240789053} O4 4354 -1 1 {} H 0.0 {0.609063469778 0.316844529258 0.456461955477} H3 4355 -1 8 {} O 0.0 {0.585752372592 0.340369814975 0.445879602885} O5 4356 -1 1 {} H 0.0 {0.590870896253 0.347859203629 0.451165236344} H4 4357 -1 8 {} O 0.0 {0.58378990389 0.325882107503 0.41963465122} O6 4358 -1 1 {} H 0.0 {0.587457921004 0.325447243043 0.409807350421} H5 4359 -1 8 {} O 0.0 {0.590996029367 0.35504781218 0.420193702106} O7 4360 -1 1 {} H 0.0 {0.590601167863 0.353365759661 0.409837207639} H6 4361 -1 14 {} Si 0.0 {0.694009517475 0.401509401163 0.500369874143} Si1 4362 -1 8 {} O 0.0 {0.707649512705 0.412045442693 0.493994932244} O1 4363 -1 14 {} Si 0.0 {0.706788867631 0.428744192713 0.501686515441} Si2 4364 -1 8 {} O 0.0 {0.715372352374 0.440844117463 0.490830739845} O2 4365 -1 1 {} H 0.0 {0.721611631904 0.435685962387 0.484132370769} H1 4366 -1 8 {} O 0.0 {0.689241082677 0.433681818817 0.503697629163} O3 4367 -1 1 {} H 0.0 {0.684932500214 0.428233036171 0.51149403042} H2 4368 -1 8 {} O 0.0 {0.714947535204 0.428445209257 0.518161097145} O4 4369 -1 1 {} H 0.0 {0.721251171243 0.436800268778 0.519067517723} H3 4370 -1 8 {} O 0.0 {0.69809411101 0.38384868374 0.497418139675} O5 4371 -1 1 {} H 0.0 {0.703711264074 0.380168373692 0.50547041513} H4 4372 -1 8 {} O 0.0 {0.678364988413 0.405671273764 0.491569936991} O6 4373 -1 1 {} H 0.0 {0.678926015924 0.402286002479 0.481656517343} H5 4374 -1 8 {} O 0.0 {0.691973942972 0.404377023095 0.518446223578} O7 4375 -1 1 {} H 0.0 {0.686663551321 0.413274299993 0.520008350441} H6 4376 -1 14 {} Si 0.0 {0.701721714762 0.515652825204 0.536301978503} Si1 4377 -1 8 {} O 0.0 {0.691486626525 0.5306884715 0.533862369834} O1 4378 -1 14 {} Si 0.0 {0.675487119777 0.528499437209 0.542650128125} Si2 4379 -1 8 {} O 0.0 {0.664572468464 0.517480580463 0.532772563566} O2 4380 -1 1 {} H 0.0 {0.66767365368 0.517600433153 0.522739711882} H1 4381 -1 8 {} O 0.0 {0.678544626766 0.520909162138 0.559140094171} O3 4382 -1 1 {} H 0.0 {0.671904197074 0.525010384214 0.566159330069} H2 4383 -1 8 {} O 0.0 {0.667366263615 0.544855355409 0.544830348001} O4 4384 -1 1 {} H 0.0 {0.665818819222 0.549253175487 0.535426253364} H3 4385 -1 8 {} O 0.0 {0.718501978208 0.518363165018 0.529255741174} O5 4386 -1 1 {} H 0.0 {0.725556002901 0.518616507442 0.53703446695} H4 4387 -1 8 {} O 0.0 {0.693715404685 0.501404899806 0.527887749023} O6 4388 -1 1 {} H 0.0 {0.683395969448 0.503189917351 0.527089331494} H5 4389 -1 8 {} O 0.0 {0.703084836407 0.51213616226 0.554260764044} O7 4390 -1 1 {} H 0.0 {0.693554922171 0.510142542232 0.558165471813} H6 4391 -1 14 {} Si 0.0 {0.313084325659 0.555306431999 0.609183721307} Si1 4392 -1 8 {} O 0.0 {0.313097011377 0.555742535557 0.627556437987} O1 4393 -1 1 {} H 0.0 {0.306083518673 0.585945488903 0.6166767676} H2 4394 -1 8 {} O 0.0 {0.327119562807 0.544985954329 0.603264696546} O5 4395 -1 1 {} H 0.0 {0.323586418885 0.537938026258 0.596338724911} H4 4396 -1 8 {} O 0.0 {0.314851214135 0.572448038588 0.602693802564} O6 4397 -1 1 {} H 0.0 {0.313989786961 0.572347285206 0.592222112189} H5 4398 -1 8 {} O 0.0 {0.297241106784 0.548062463255 0.603227366676} O7 4399 -1 1 {} H 0.0 {0.298643692611 0.543983711785 0.593661470447} H6 4400 -1 14 {} Si 0.0 {0.461572953994 0.595086240313 0.663567665746} Si1 4401 -1 8 {} O 0.0 {0.469373448981 0.593088969066 0.646990570876} O1 4402 -1 14 {} Si 0.0 {0.484391934939 0.582543780755 0.648482781462} Si2 4403 -1 8 {} O 0.0 {0.498535748323 0.59073997874 0.640055613143} O2 4404 -1 1 {} H 0.0 {0.495839273677 0.593061786151 0.630180723448} H1 4405 -1 8 {} O 0.0 {0.488408161535 0.580102891468 0.666265132642} O3 4406 -1 1 {} H 0.0 {0.494151218777 0.588191502307 0.669682122331} H2 4407 -1 8 {} O 0.0 {0.481190249845 0.566214701307 0.640625673512} O4 4408 -1 1 {} H 0.0 {0.484585652916 0.566389707834 0.630694009938} H3 4409 -1 8 {} O 0.0 {0.444151195981 0.600569660679 0.661521874656} O5 4410 -1 1 {} H 0.0 {0.437709452111 0.593052233659 0.665037756966} H4 4411 -1 8 {} O 0.0 {0.470869152527 0.60765092927 0.673240475889} O6 4412 -1 1 {} H 0.0 {0.476222440768 0.602870382811 0.680905903695} H5 4413 -1 8 {} O 0.0 {0.461869769671 0.57904986247 0.672548824717} O7 4414 -1 1 {} H 0.0 {0.461663281925 0.580831514317 0.682886903036} H6 4415 -1 8 {} O 0.0 {0.276606420616 0.460504067489 0.588126981042} O2 4416 -1 1 {} H 0.0 {0.276537753017 0.464331212788 0.597916176154} H1 4417 -1 8 {} O 0.0 {0.26069635465 0.468558988676 0.563914036075} O3 4418 -1 8 {} O 0.0 {0.280776733738 0.438276579986 0.585348883102} O6 4419 -1 1 {} H 0.0 {0.288701895911 0.435281218512 0.579143111053} H5 4420 -1 8 {} O 0.0 {0.267100446061 0.428759019532 0.560401344422} O7 4421 -1 1 {} H 0.0 {0.275328753224 0.434182654683 0.556778257554} H6 4422 -1 1 {} H 0.0 {0.705418132955 0.618283175029 0.536543444142} H6 4423 -1 14 {} Si 0.0 {0.452498447917 0.276488315992 0.517497146812} Si1 4424 -1 8 {} O 0.0 {0.448442694762 0.261884925759 0.50669818879} O1 4425 -1 14 {} Si 0.0 {0.442309760664 0.26742476037 0.490047023522} Si2 4426 -1 8 {} O 0.0 {0.456502254409 0.270919866636 0.478713725983} O2 4427 -1 1 {} H 0.0 {0.465429333231 0.271554654538 0.484184663506} H1 4428 -1 8 {} O 0.0 {0.431889774669 0.254204939471 0.482722834226} O3 4429 -1 1 {} H 0.0 {0.425836157797 0.258340773341 0.475214503062} H2 4430 -1 8 {} O 0.0 {0.432273811125 0.28265353359 0.491791355742} O4 4431 -1 1 {} H 0.0 {0.436540410953 0.290237817874 0.48589722065} H3 4432 -1 8 {} O 0.0 {0.437879620572 0.280697682758 0.527864879463} O5 4433 -1 1 {} H 0.0 {0.44027509366 0.279279654029 0.538008877497} H4 4434 -1 8 {} O 0.0 {0.456930430117 0.290933793639 0.506982862082} O6 4435 -1 1 {} H 0.0 {0.454945428441 0.299798654139 0.512239369027} H5 4436 -1 8 {} O 0.0 {0.466719408219 0.272348447495 0.52850651707} O7 4437 -1 1 {} H 0.0 {0.475611639982 0.272272141282 0.522893334462} H6 4438 -1 14 {} Si 0.0 {0.30734383868 0.551656859583 0.559661835714} Si1 4439 -1 8 {} O 0.0 {0.301192337108 0.565271504873 0.54891645752} O1 4440 -1 14 {} Si 0.0 {0.311237816687 0.565894935483 0.533482394589} Si2 4441 -1 8 {} O 0.0 {0.300062744654 0.567166879539 0.518946306824} O2 4442 -1 1 {} H 0.0 {0.30338857522 0.56066687283 0.511406717432} H1 4443 -1 8 {} O 0.0 {0.3223692483 0.580515167382 0.533960457141} O3 4444 -1 1 {} H 0.0 {0.328114546682 0.580238021772 0.542742755477} H2 4445 -1 8 {} O 0.0 {0.321341760154 0.55058258378 0.532111565236} O4 4446 -1 1 {} H 0.0 {0.321634119951 0.547488883071 0.522084366866} H3 4447 -1 8 {} O 0.0 {0.325691741949 0.552522993438 0.56064435198} O5 4448 -1 1 {} H 0.0 {0.329085544905 0.560833398779 0.555199779848} H4 4449 -1 8 {} O 0.0 {0.302275310663 0.535425030025 0.55256811248} O6 4450 -1 1 {} H 0.0 {0.307409938074 0.527698643608 0.5574708181} H5 4451 -1 8 {} O 0.0 {0.300216747794 0.553417462417 0.576517766856} O7 4452 -1 1 {} H 0.0 {0.291554569193 0.547524337076 0.577272428045} H6 4453 -1 14 {} Si 0.0 {0.5353489412 0.591927891587 0.576302272288} Si1 4454 -1 8 {} O 0.0 {0.543104273213 0.582599314883 0.562442598638} O1 4455 -1 14 {} Si 0.0 {0.559648864463 0.589739232671 0.558679433226} Si2 4456 -1 8 {} O 0.0 {0.572772718301 0.578436457447 0.564895867348} O2 4457 -1 1 {} H 0.0 {0.570705982037 0.575840515977 0.574857264662} H1 4458 -1 8 {} O 0.0 {0.561450732038 0.591785302295 0.540480042015} O3 4459 -1 1 {} H 0.0 {0.552252304942 0.589802232237 0.535822882181} H2 4460 -1 8 {} O 0.0 {0.561285087168 0.606121069555 0.56686939968} O4 4461 -1 1 {} H 0.0 {0.561486727206 0.604801391208 0.577272470912} H3 4462 -1 8 {} O 0.0 {0.54123053682 0.585112020204 0.592343345529} O5 4463 -1 1 {} H 0.0 {0.547390340076 0.576803967723 0.590556563896} H4 4464 -1 8 {} O 0.0 {0.517048611099 0.590287970133 0.575298013405} O6 4465 -1 1 {} H 0.0 {0.512834654951 0.599610023222 0.572937367931} H5 4466 -1 8 {} O 0.0 {0.539981555963 0.609694413452 0.575133423203} O7 4467 -1 1 {} H 0.0 {0.536261448048 0.614823893042 0.583509129259} H6 4468 -1 14 {} Si 0.0 {0.609155941996 0.484591882723 0.584930284282} Si1 4469 -1 8 {} O 0.0 {0.594374711409 0.47386922518 0.582364650965} O1 4470 -1 14 {} Si 0.0 {0.589417501487 0.465984946809 0.598271250874} Si2 4471 -1 8 {} O 0.0 {0.577518080351 0.452368735524 0.594838087226} O2 4472 -1 1 {} H 0.0 {0.573362766144 0.453696070899 0.58527870993} H1 4473 -1 8 {} O 0.0 {0.604279129921 0.459151679747 0.606700783872} O3 4474 -1 1 {} H 0.0 {0.604527239491 0.462554531858 0.616636302343} H2 4475 -1 8 {} O 0.0 {0.581405933451 0.478499766996 0.60912286777} O4 4476 -1 1 {} H 0.0 {0.571781749688 0.480618343714 0.605490525755} H3 4477 -1 8 {} O 0.0 {0.624366212245 0.475096333143 0.581102798581} O5 4478 -1 1 {} H 0.0 {0.631269879353 0.481336061837 0.576262538151} H4 4479 -1 8 {} O 0.0 {0.60977923653 0.490296313238 0.602412300669} O6 4480 -1 1 {} H 0.0 {0.600489731157 0.494335044392 0.605102481916} H5 4481 -1 8 {} O 0.0 {0.608146126803 0.499127571851 0.573710740143} O7 4482 -1 1 {} H 0.0 {0.608155207124 0.507928490222 0.579399808313} H6 4483 -1 14 {} Si 0.0 {0.520155160818 0.68269652825 0.409825342457} Si1 4484 -1 8 {} O 0.0 {0.519814969591 0.697729918436 0.398938769823} O1 4485 -1 14 {} Si 0.0 {0.511298171589 0.711799548815 0.407430189799} Si2 4486 -1 8 {} O 0.0 {0.520079394326 0.715870671862 0.423104131741} O2 4487 -1 1 {} H 0.0 {0.513684576256 0.714119358311 0.431240705813} H1 4488 -1 8 {} O 0.0 {0.493923625873 0.707098895821 0.411134443069} O4 4489 -1 1 {} H 0.0 {0.493211742807 0.69666614647 0.411863687615} H3 4490 -1 8 {} O 0.0 {0.504431472178 0.681430551058 0.419242783469} O5 4491 -1 1 {} H 0.0 {0.506215088794 0.683821419533 0.429314977655} H4 4492 -1 8 {} O 0.0 {0.53426840052 0.683636385137 0.421552557356} O6 4493 -1 1 {} H 0.0 {0.539666615075 0.674629125507 0.421246082266} H5 4494 -1 8 {} O 0.0 {0.52235770634 0.66780090032 0.399359116712} O7 4495 -1 1 {} H 0.0 {0.525476349253 0.670735943603 0.389761297398} H6 4496 -1 14 {} Si 0.0 {0.458794317232 0.654001371372 0.463620974472} Si1 4497 -1 8 {} O 0.0 {0.459388830695 0.639833742313 0.475328896963} O1 4498 -1 14 {} Si 0.0 {0.442398948026 0.633220753709 0.477782269686} Si2 4499 -1 8 {} O 0.0 {0.434718968155 0.629773195767 0.4614183879} O2 4500 -1 1 {} H 0.0 {0.439902259276 0.63502601435 0.453951135566} H1 4501 -1 8 {} O 0.0 {0.443256860251 0.617667570902 0.487560029766} O3 4502 -1 1 {} H 0.0 {0.450113494088 0.618867017184 0.495420003142} H2 4503 -1 8 {} O 0.0 {0.432247837923 0.645606175399 0.486845515499} O4 4504 -1 1 {} H 0.0 {0.425625776108 0.650253171063 0.480153809632} H3 4505 -1 8 {} O 0.0 {0.475852202566 0.660214770048 0.460663984875} O5 4506 -1 1 {} H 0.0 {0.482426252499 0.652074155114 0.459804363821} H4 4507 -1 8 {} O 0.0 {0.448516149563 0.667461790961 0.470803776044} O6 4508 -1 1 {} H 0.0 {0.44942787486 0.676083827614 0.464883710318} H5 4509 -1 8 {} O 0.0 {0.45143057644 0.64847860238 0.447691895003} O7 4510 -1 1 {} H 0.0 {0.448319540325 0.656863068645 0.442196866868} H6 4511 -1 14 {} Si 0.0 {0.526723102556 0.353105245786 0.318205680929} Si1 4512 -1 8 {} O 0.0 {0.537241355968 0.346466928582 0.304638690276} O1 4513 -1 8 {} O 0.0 {0.513550979281 0.353605261994 0.287577780261} O3 4514 -1 8 {} O 0.0 {0.531517503682 0.345189931649 0.334110872065} O5 4515 -1 1 {} H 0.0 {0.541037547306 0.348577969516 0.336964250053} H4 4516 -1 8 {} O 0.0 {0.509048064613 0.349469571227 0.314625789993} O6 4517 -1 1 {} H 0.0 {0.503281294388 0.358051992828 0.316464522161} H5 4518 -1 8 {} O 0.0 {0.529103857871 0.371306049857 0.319460676577} O7 4519 -1 1 {} H 0.0 {0.524631974148 0.375984566585 0.31119390899} H6 4520 -1 8 {} O 0.0 {0.649041635829 0.349240017702 0.35143135071} O4 4521 -1 1 {} H 0.0 {0.638691604526 0.347700110433 0.350571497245} H3 4522 -1 14 {} Si 0.0 {0.373293877463 0.322932912784 0.621794025294} Si1 4523 -1 8 {} O 0.0 {0.365748075073 0.33974855649 0.622270044506} O1 4524 -1 8 {} O 0.0 {0.34659036148 0.356038503249 0.638751076877} O4 4525 -1 8 {} O 0.0 {0.386168349737 0.3215525332 0.634933142982} O5 4526 -1 8 {} O 0.0 {0.381214586234 0.32023361257 0.605434377224} O6 4527 -1 1 {} H 0.0 {0.390365246114 0.315277318173 0.606762410691} H5 4528 -1 14 {} Si 0.0 {0.295185654826 0.417808917283 0.496645502859} Si1 4529 -1 8 {} O 0.0 {0.309117250054 0.411868588705 0.507072804375} O1 4530 -1 14 {} Si 0.0 {0.316868898645 0.426305797728 0.515429705762} Si2 4531 -1 8 {} O 0.0 {0.334003998985 0.422030659422 0.520598138861} O2 4532 -1 1 {} H 0.0 {0.337259782752 0.41359402114 0.515277956723} H1 4533 -1 8 {} O 0.0 {0.317351779877 0.440536080134 0.503782817031} O3 4534 -1 1 {} H 0.0 {0.308181820342 0.445639810612 0.50413617014} H2 4535 -1 8 {} O 0.0 {0.306941185429 0.430855155948 0.530234315721} O4 4536 -1 1 {} H 0.0 {0.307568148028 0.423165007903 0.537351594073} H3 4537 -1 8 {} O 0.0 {0.301888729359 0.425655616878 0.481415733279} O5 4538 -1 1 {} H 0.0 {0.294946571235 0.4246297715 0.473621644134} H4 4539 -1 8 {} O 0.0 {0.285368739626 0.430161980842 0.506090702738} O6 4540 -1 1 {} H 0.0 {0.287138995061 0.428890431791 0.516366941708} H5 4541 -1 8 {} O 0.0 {0.28438192532 0.40363999185 0.492026610027} O7 4542 -1 1 {} H 0.0 {0.280510629592 0.399222753565 0.500723468006} H6 4543 -1 14 {} Si 0.0 {0.469272304349 0.421860481801 0.480043902398} Si1 4544 -1 8 {} O 0.0 {0.480967963094 0.425922876146 0.493645249999} O1 4545 -1 14 {} Si 0.0 {0.474076067264 0.439754667311 0.503575274731} Si2 4546 -1 8 {} O 0.0 {0.458348293512 0.434443549788 0.511456447017} O2 4547 -1 1 {} H 0.0 {0.453444248278 0.427639767501 0.505179916216} H1 4548 -1 8 {} O 0.0 {0.48611971996 0.444583617102 0.516625609397} O3 4549 -1 1 {} H 0.0 {0.481211013421 0.445009033982 0.525903303895} H2 4550 -1 8 {} O 0.0 {0.470842380792 0.45408233326 0.492537853405} O4 4551 -1 1 {} H 0.0 {0.462010505731 0.452415672763 0.48714310383} H3 4552 -1 8 {} O 0.0 {0.455324353399 0.411919691236 0.48675075095} O5 4553 -1 1 {} H 0.0 {0.449956988595 0.417684327934 0.493685224754} H4 4554 -1 8 {} O 0.0 {0.478041282237 0.412178744494 0.467092389041} O6 4555 -1 1 {} H 0.0 {0.483159824986 0.418749207535 0.460698523664} H5 4556 -1 8 {} O 0.0 {0.462736293652 0.437424498455 0.472703180941} O7 4557 -1 1 {} H 0.0 {0.452932476401 0.439040876217 0.476100482373} H6 4558 -1 8 {} O 0.0 {0.504594626779 0.547018985223 0.259453493562} O2 4559 -1 1 {} H 0.0 {0.49817367225 0.555231077306 0.260661732766} H1 4560 -1 14 {} Si 0.0 {0.371224754157 0.410141480062 0.408370147631} Si1 4561 -1 8 {} O 0.0 {0.373222714424 0.403365014789 0.425332668338} O1 4562 -1 14 {} Si 0.0 {0.356726445097 0.401054718203 0.433044304718} Si2 4563 -1 8 {} O 0.0 {0.351491622352 0.383498139105 0.431233435068} O2 4564 -1 1 {} H 0.0 {0.349827248792 0.381375028312 0.421091986578} H1 4565 -1 8 {} O 0.0 {0.357750293107 0.405328012602 0.45089082166} O3 4566 -1 1 {} H 0.0 {0.366275883106 0.411235034215 0.452568709374} H2 4567 -1 8 {} O 0.0 {0.344485582678 0.412025954532 0.424782172978} O4 4568 -1 1 {} H 0.0 {0.336588351254 0.406228497477 0.421014941586} H3 4569 -1 8 {} O 0.0 {0.376544362713 0.427757007405 0.408194097624} O5 4570 -1 1 {} H 0.0 {0.381945481978 0.429690065993 0.399428921327} H4 4571 -1 8 {} O 0.0 {0.353504227027 0.409044685944 0.40327970642} O6 4572 -1 1 {} H 0.0 {0.352696437276 0.410529713769 0.39292210918} H5 4573 -1 8 {} O 0.0 {0.381727745217 0.400393144345 0.396798576081} O7 4574 -1 1 {} H 0.0 {0.376516890638 0.398712767362 0.387844944437} H6 4575 -1 14 {} Si 0.0 {0.364634912289 0.389740753428 0.560190524943} Si1 4576 -1 8 {} O 0.0 {0.356493493118 0.406312883029 0.560014738892} O1 4577 -1 14 {} Si 0.0 {0.340290990746 0.405325529262 0.551293104391} Si2 4578 -1 8 {} O 0.0 {0.340212420107 0.417089296966 0.537130900026} O2 4579 -1 1 {} H 0.0 {0.34388318858 0.426403934042 0.540304758741} H1 4580 -1 8 {} O 0.0 {0.337665004402 0.38822767578 0.545046967585} O3 4581 -1 1 {} H 0.0 {0.339097299617 0.381404014497 0.55288599545} H2 4582 -1 8 {} O 0.0 {0.326766644671 0.409740564665 0.562976207947} O4 4583 -1 1 {} H 0.0 {0.318881990467 0.41421767574 0.557672218829} H3 4584 -1 8 {} O 0.0 {0.364557059625 0.382604387589 0.543252285128} O5 4585 -1 1 {} H 0.0 {0.368721964378 0.372958520029 0.54353062165} H4 4586 -1 8 {} O 0.0 {0.355586780988 0.378448648536 0.571595801418} O6 4587 -1 1 {} H 0.0 {0.361021952818 0.377436006838 0.580534213259} H5 4588 -1 8 {} O 0.0 {0.382010842273 0.391584320365 0.565954749338} O7 4589 -1 1 {} H 0.0 {0.382668820837 0.388706546378 0.576030717342} H6 4590 -1 1 {} H 0.0 {0.257182327789 0.471716394683 0.528035158085} H2 4591 -1 8 {} O 0.0 {0.256579210189 0.429832630104 0.489559195655} O7 4592 -1 14 {} Si 0.0 {0.591844169101 0.297378855139 0.37926633197} Si1 4593 -1 1 {} H 0.0 {0.579224775882 0.297877947439 0.359479939787} H2 4594 -1 8 {} O 0.0 {0.590537709589 0.313600317396 0.370666433236} O5 4595 -1 1 {} H 0.0 {0.582291660642 0.313463859355 0.364162889825} H4 4596 -1 8 {} O 0.0 {0.597681141604 0.300003379179 0.396497018912} O6 4597 -1 1 {} H 0.0 {0.59125274282 0.295031834468 0.403148620249} H5 4598 -1 8 {} O 0.0 {0.575329809367 0.289291653319 0.379599535574} O7 4599 -1 1 {} H 0.0 {0.570900492863 0.290789800793 0.389006929256} H6 4600 -1 14 {} Si 0.0 {0.500852884087 0.591261830664 0.334203812317} Si1 4601 -1 8 {} O 0.0 {0.500358339798 0.574106364857 0.340646066403} O1 4602 -1 14 {} Si 0.0 {0.505180684896 0.562619862629 0.327170208815} Si2 4603 -1 8 {} O 0.0 {0.490407840966 0.553238129058 0.321443459554} O2 4604 -1 1 {} H 0.0 {0.481716802949 0.558694221204 0.323699172382} H1 4605 -1 8 {} O 0.0 {0.512096873768 0.572302714163 0.313129739133} O3 4606 -1 1 {} H 0.0 {0.512935083773 0.582396067902 0.315938262276} H2 4607 -1 8 {} O 0.0 {0.517895229443 0.550904540328 0.333407802431} O4 4608 -1 1 {} H 0.0 {0.516819132783 0.549824564562 0.343799266988} H3 4609 -1 8 {} O 0.0 {0.495632800962 0.591216329345 0.316544132441} O5 4610 -1 1 {} H 0.0 {0.501797276757 0.597683289076 0.311038202418} H4 4611 -1 8 {} O 0.0 {0.517962457221 0.597843081396 0.335440054882} O6 4612 -1 1 {} H 0.0 {0.520818620411 0.601863434568 0.326162694628} H5 4613 -1 8 {} O 0.0 {0.489415261327 0.601895295368 0.344015290154} O7 4614 -1 1 {} H 0.0 {0.495002286549 0.608129616029 0.350345933886} H6 4615 -1 14 {} Si 0.0 {0.328568022976 0.564976104965 0.591936554987} Si1 4616 -1 8 {} O 0.0 {0.312419403882 0.556026422155 0.590407128997} O1 4617 -1 14 {} Si 0.0 {0.298290111369 0.567830942572 0.592358810406} Si2 4618 -1 8 {} O 0.0 {0.286532769966 0.565682408659 0.57837979288} O2 4619 -1 1 {} H 0.0 {0.289359278769 0.571964383053 0.570458492839} H1 4620 -1 8 {} O 0.0 {0.28956951368 0.564468852576 0.608229361479} O3 4621 -1 1 {} H 0.0 {0.296267882622 0.560164306696 0.615067202796} H2 4622 -1 8 {} O 0.0 {0.304619188704 0.585126082206 0.592387677836} O4 4623 -1 1 {} H 0.0 {0.302671614526 0.589564519317 0.583076419222} H3 4624 -1 8 {} O 0.0 {0.32557178184 0.583125233162 0.59235314742} O5 4625 -1 1 {} H 0.0 {0.329955337725 0.587166906891 0.600995914429} H4 4626 -1 8 {} O 0.0 {0.339218150149 0.560927094546 0.577427268619} O6 4627 -1 1 {} H 0.0 {0.348670255981 0.565335321965 0.578683768767} H5 4628 -1 8 {} O 0.0 {0.336987701012 0.559880030955 0.607587870719} O7 4629 -1 1 {} H 0.0 {0.343437250316 0.551806290584 0.605714398804} H6 4630 -1 14 {} Si 0.0 {0.340392674224 0.585777876043 0.655274527999} Si1 4631 -1 8 {} O 0.0 {0.339124774888 0.571825882783 0.667170910322} O1 4632 -1 8 {} O 0.0 {0.356138349848 0.584413346885 0.645888244023} O5 4633 -1 1 {} H 0.0 {0.354264903692 0.579918206082 0.636585649046} H4 4634 -1 8 {} O 0.0 {0.326236289746 0.585183160724 0.643562474702} O7 4635 -1 1 {} H 0.0 {0.327979720492 0.59183991936 0.635645591238} H6 4636 -1 8 {} O 0.0 {0.680537417401 0.560403285879 0.345438228329} O2 4637 -1 1 {} H 0.0 {0.673625942681 0.556561040043 0.338543091081} H1 4638 -1 8 {} O 0.0 {0.698191302468 0.537783885986 0.354352576968} O3 4639 -1 14 {} Si 0.0 {0.296851471134 0.429436156672 0.600567442755} Si1 4640 -1 8 {} O 0.0 {0.313722319731 0.42980517705 0.607833463175} O1 4641 -1 14 {} Si 0.0 {0.326124506453 0.428851966239 0.594322982682} Si2 4642 -1 8 {} O 0.0 {0.318392222904 0.421227070806 0.579462535098} O2 4643 -1 1 {} H 0.0 {0.313041770996 0.412658257528 0.582331749287} H1 4644 -1 8 {} O 0.0 {0.332019720561 0.445800126054 0.590186436057} O3 4645 -1 1 {} H 0.0 {0.323751346249 0.452028617797 0.58839007185} H2 4646 -1 8 {} O 0.0 {0.340347653424 0.418565414555 0.599784411757} O4 4647 -1 1 {} H 0.0 {0.336949302812 0.411214581591 0.606464389825} H3 4648 -1 8 {} O 0.0 {0.292086756056 0.446431619946 0.59538655577} O5 4649 -1 1 {} H 0.0 {0.299683738164 0.450509255541 0.589395269361} H4 4650 -1 8 {} O 0.0 {0.296728191988 0.418278309616 0.585921411392} O7 4651 -1 1 {} H 0.0 {0.290256743632 0.41020934473 0.587733445995} H6 4652 -1 1 {} H 0.0 {0.657935114082 0.312710081571 0.426986677864} H1 4653 -1 1 {} H 0.0 {0.649260066979 0.321693680814 0.402838452088} H3 4654 -1 8 {} O 0.0 {0.631616836123 0.285655434692 0.440278374005} O7 4655 -1 1 {} H 0.0 {0.622205782237 0.286383770344 0.43569862761} H6 4656 -1 14 {} Si 0.0 {0.549804582195 0.696089801613 0.430938929161} Si1 4657 -1 8 {} O 0.0 {0.547741557745 0.708998248918 0.417794462467} O1 4658 -1 14 {} Si 0.0 {0.532560319004 0.705410996197 0.407599901657} Si2 4659 -1 8 {} O 0.0 {0.518411957499 0.700313498264 0.418478704405} O2 4660 -1 1 {} H 0.0 {0.521404766552 0.700296178018 0.428530267591} H1 4661 -1 8 {} O 0.0 {0.536169923781 0.69173317953 0.395608580971} O4 4662 -1 1 {} H 0.0 {0.532251286313 0.682762482991 0.399210180987} H3 4663 -1 8 {} O 0.0 {0.557652544062 0.681157582174 0.423633286502} O5 4664 -1 1 {} H 0.0 {0.568033951986 0.682588270716 0.423099900939} H4 4665 -1 8 {} O 0.0 {0.533302381971 0.691577693703 0.437881356712} O6 4666 -1 1 {} H 0.0 {0.534334152454 0.68898411695 0.447992115164} H5 4667 -1 8 {} O 0.0 {0.560498600051 0.702662803234 0.444385501227} O7 4668 -1 1 {} H 0.0 {0.556486167975 0.711687802301 0.447938800821} H6 4669 -1 8 {} O 0.0 {0.342004355381 0.494918205721 0.674962824708} O1 4670 -1 14 {} Si 0.0 {0.342279710034 0.482660476254 0.661195680404} Si2 4671 -1 8 {} O 0.0 {0.326230457735 0.473695954475 0.660592052521} O2 4672 -1 1 {} H 0.0 {0.325396168805 0.468666263283 0.65140467039} H1 4673 -1 8 {} O 0.0 {0.344984372697 0.491422850061 0.645242770423} O3 4674 -1 1 {} H 0.0 {0.349794755483 0.484977396804 0.638494227553} H2 4675 -1 8 {} O 0.0 {0.355917810301 0.470618041167 0.66394210271} O4 4676 -1 1 {} H 0.0 {0.358059882184 0.465663843914 0.654927690611} H3 4677 -1 14 {} Si 0.0 {0.458114932157 0.561501355333 0.667366433032} Si1 4678 -1 8 {} O 0.0 {0.457904872476 0.545803873359 0.65792615224} O1 4679 -1 14 {} Si 0.0 {0.445059374365 0.534696798458 0.66491770872} Si2 4680 -1 8 {} O 0.0 {0.42847247235 0.541979321199 0.661881584545} O2 4681 -1 1 {} H 0.0 {0.42914292951 0.552452894927 0.662362881374} H1 4682 -1 8 {} O 0.0 {0.446164954497 0.518215603089 0.656815281353} O3 4683 -1 1 {} H 0.0 {0.454125958771 0.518227613588 0.649958308285} H2 4684 -1 8 {} O 0.0 {0.447736836878 0.532837595139 0.683035665124} O4 4685 -1 1 {} H 0.0 {0.444537005125 0.541548270907 0.687949110629} H3 4686 -1 8 {} O 0.0 {0.471660426756 0.572142688271 0.661037889382} O5 4687 -1 1 {} H 0.0 {0.469010396812 0.575791456403 0.651577187398} H4 4688 -1 8 {} O 0.0 {0.460860600706 0.557957662591 0.685229538394} O6 4689 -1 1 {} H 0.0 {0.451598489021 0.557566047781 0.690173415511} H5 4690 -1 8 {} O 0.0 {0.442021669234 0.570128222417 0.665200596674} O7 4691 -1 1 {} H 0.0 {0.437768866524 0.571994671906 0.674606843258} H6 4692 -1 14 {} Si 0.0 {0.650299113114 0.376182839954 0.385560760251} Si1 4693 -1 8 {} O 0.0 {0.644519254391 0.391105379274 0.394660439961} O1 4694 -1 14 {} Si 0.0 {0.652618259949 0.406085427491 0.387679545377} Si2 4695 -1 8 {} O 0.0 {0.646298249969 0.409111637327 0.370665407718} O2 4696 -1 1 {} H 0.0 {0.640033386249 0.401185420901 0.367812367033} H1 4697 -1 8 {} O 0.0 {0.648826396585 0.420627311999 0.398302256017} O3 4698 -1 1 {} H 0.0 {0.649524075198 0.417845107342 0.408403843439} H2 4699 -1 8 {} O 0.0 {0.670827369816 0.403509701862 0.387087052998} O4 4700 -1 1 {} H 0.0 {0.672924318312 0.39461255864 0.381923900454} H3 4701 -1 8 {} O 0.0 {0.668169518975 0.373441305724 0.388992206078} O5 4702 -1 1 {} H 0.0 {0.669187489233 0.366815651051 0.397075728081} H4 4703 -1 8 {} O 0.0 {0.647839844128 0.378673449893 0.367490932692} O6 4704 -1 1 {} H 0.0 {0.64281355657 0.370368193316 0.363481577563} H5 4705 -1 8 {} O 0.0 {0.640671358868 0.361514778014 0.391090886348} O7 4706 -1 1 {} H 0.0 {0.633347808866 0.359238555479 0.383918781569} H6 4707 -1 14 {} Si 0.0 {0.485794739403 0.393309972869 0.509575241924} Si1 4708 -1 8 {} O 0.0 {0.473421774923 0.380773068567 0.50425099861} O1 4709 -1 14 {} Si 0.0 {0.466650135201 0.372172250727 0.519044427543} Si2 4710 -1 8 {} O 0.0 {0.474616871261 0.378846597428 0.534224021027} O2 4711 -1 1 {} H 0.0 {0.483172568013 0.373181069977 0.536453466356} H1 4712 -1 8 {} O 0.0 {0.448476594945 0.374904696048 0.519941934225} O3 4713 -1 1 {} H 0.0 {0.443720894987 0.369215679022 0.512508372616} H2 4714 -1 8 {} O 0.0 {0.470077447769 0.354144870752 0.517743528112} O4 4715 -1 1 {} H 0.0 {0.477426070322 0.351483295254 0.524752867673} H3 4716 -1 8 {} O 0.0 {0.487296895242 0.393071808618 0.527907173564} O5 4717 -1 1 {} H 0.0 {0.487444671261 0.402927780462 0.531524434926} H4 4718 -1 8 {} O 0.0 {0.480337253888 0.409996928984 0.504092703529} O6 4719 -1 1 {} H 0.0 {0.472249946075 0.409016232476 0.497470043346} H5 4720 -1 8 {} O 0.0 {0.502117593576 0.389411926871 0.502027013206} O7 4721 -1 1 {} H 0.0 {0.503422075828 0.395185703514 0.493354422117} H6 4722 -1 14 {} Si 0.0 {0.557413310246 0.454808008525 0.667940265416} Si1 4723 -1 8 {} O 0.0 {0.575311965329 0.458775195437 0.666484576586} O1 4724 -1 14 {} Si 0.0 {0.577851227504 0.470377612996 0.652443159661} Si2 4725 -1 8 {} O 0.0 {0.588681905126 0.484224896366 0.657843074375} O2 4726 -1 1 {} H 0.0 {0.59111617393 0.482992358326 0.667984073279} H1 4727 -1 8 {} O 0.0 {0.585806223695 0.461452827887 0.638451339883} O3 4728 -1 1 {} H 0.0 {0.578475524275 0.456276881458 0.632995491077} H2 4729 -1 8 {} O 0.0 {0.561596663826 0.477063714502 0.647004198182} O4 4730 -1 1 {} H 0.0 {0.560897698068 0.487178407969 0.649727224276} H3 4731 -1 8 {} O 0.0 {0.552729380825 0.453906464875 0.685650890599} O5 4732 -1 1 {} H 0.0 {0.542255523877 0.453568016784 0.686450385146} H4 4733 -1 8 {} O 0.0 {0.554074440296 0.43862060235 0.659936597221} O6 4734 -1 1 {} H 0.0 {0.544329315483 0.435508539654 0.662268300347} H5 4735 -1 8 {} O 0.0 {0.547504013305 0.467929882113 0.659713577454} O7 4736 -1 1 {} H 0.0 {0.539455458334 0.470609328521 0.665917019775} H6 4737 -1 14 {} Si 0.0 {0.39387487078 0.417223526795 0.506025618246} Si1 4738 -1 8 {} O 0.0 {0.384230509421 0.401626051803 0.507469407816} O1 4739 -1 14 {} Si 0.0 {0.391892362328 0.388715347161 0.496843560518} Si2 4740 -1 8 {} O 0.0 {0.39439361221 0.395424753489 0.479896098142} O2 4741 -1 1 {} H 0.0 {0.389917126851 0.404898874641 0.479203496806} H1 4742 -1 8 {} O 0.0 {0.408133664473 0.383766742409 0.50394192573} O3 4743 -1 1 {} H 0.0 {0.408734647351 0.38705051682 0.513897976615} H2 4744 -1 8 {} O 0.0 {0.380813751371 0.374048143737 0.496060735184} O4 4745 -1 1 {} H 0.0 {0.370827256955 0.377173812384 0.496926742801} H3 4746 -1 8 {} O 0.0 {0.382405598885 0.431601459404 0.506568324832} O5 4747 -1 1 {} H 0.0 {0.381960544552 0.435340438354 0.5163690166} H4 4748 -1 8 {} O 0.0 {0.40306201576 0.417301497338 0.490082397633} O6 4749 -1 1 {} H 0.0 {0.412125203002 0.412129117383 0.491253880866} H5 4750 -1 8 {} O 0.0 {0.405807442931 0.418356691069 0.519981060743} O7 4751 -1 1 {} H 0.0 {0.410630620145 0.409108892734 0.521201712769} H6 4752 -1 14 {} Si 0.0 {0.684653676656 0.443072335543 0.521440245019} Si1 4753 -1 8 {} O 0.0 {0.687895847925 0.450973205962 0.505051644849} O1 4754 -1 14 {} Si 0.0 {0.680588951024 0.440748839293 0.49155578711} Si2 4755 -1 8 {} O 0.0 {0.66622751759 0.431300643333 0.49816732754} O2 4756 -1 1 {} H 0.0 {0.666837039005 0.430851938618 0.508594645131} H1 4757 -1 8 {} O 0.0 {0.675179478737 0.451749606409 0.47779020986} O3 4758 -1 1 {} H 0.0 {0.67581285356 0.461759534375 0.480870148373} H2 4759 -1 8 {} O 0.0 {0.693192840135 0.428910664626 0.485273340904} O4 4760 -1 1 {} H 0.0 {0.688739519109 0.422483323397 0.478247381949} H3 4761 -1 8 {} O 0.0 {0.688148091117 0.455179985565 0.534791760254} O5 4762 -1 1 {} H 0.0 {0.682283740307 0.463751456159 0.533335697011} H4 4763 -1 8 {} O 0.0 {0.695583917504 0.42837843108 0.523501487506} O6 4764 -1 1 {} H 0.0 {0.692896276092 0.423219656636 0.532251818129} H5 4765 -1 8 {} O 0.0 {0.66703492734 0.437835982267 0.52247051262} O7 4766 -1 1 {} H 0.0 {0.665815914206 0.431291195831 0.530594253646} H6 4767 -1 14 {} Si 0.0 {0.348369606995 0.553352132867 0.668569814405} Si1 4768 -1 8 {} O 0.0 {0.362454441345 0.564894713858 0.665846903944} O5 4769 -1 1 {} H 0.0 {0.371500303108 0.559600410585 0.666529745954} H4 4770 -1 8 {} O 0.0 {0.340292601104 0.549656091276 0.652467510913} O6 4771 -1 1 {} H 0.0 {0.33337141614 0.557232940299 0.650229426183} H5 4772 -1 8 {} O 0.0 {0.354608957722 0.537745936913 0.676024453209} O7 4773 -1 1 {} H 0.0 {0.347396255459 0.53021566559 0.674883935617} H6 4774 -1 14 {} Si 0.0 {0.56879739957 0.60703207181 0.414451453743} Si1 4775 -1 8 {} O 0.0 {0.557370702389 0.619674583112 0.421386831395} O1 4776 -1 14 {} Si 0.0 {0.560957241012 0.622050236193 0.439291696597} Si2 4777 -1 8 {} O 0.0 {0.572443152431 0.636279073915 0.441356422984} O2 4778 -1 1 {} H 0.0 {0.57491115414 0.640163843795 0.431925468907} H1 4779 -1 8 {} O 0.0 {0.545194132177 0.625494639707 0.448300058319} O3 4780 -1 1 {} H 0.0 {0.538784077976 0.617183523523 0.447426926728} H2 4781 -1 8 {} O 0.0 {0.568710585303 0.606798815899 0.446050604604} O4 4782 -1 1 {} H 0.0 {0.5761897294 0.60348528952 0.439470190257} H3 4783 -1 8 {} O 0.0 {0.585237882567 0.608496161527 0.42257725867} O5 4784 -1 1 {} H 0.0 {0.589855565447 0.599069722148 0.422825785009} H4 4785 -1 8 {} O 0.0 {0.570650891627 0.609717466173 0.396341615043} O6 4786 -1 1 {} H 0.0 {0.571986348467 0.600463883209 0.391560894752} H5 4787 -1 8 {} O 0.0 {0.561923709902 0.590239550034 0.417485481759} O7 4788 -1 1 {} H 0.0 {0.561228735534 0.585059933984 0.408379188619} H6 4789 -1 14 {} Si 0.0 {0.399052696646 0.693957921504 0.527986086755} Si1 4790 -1 8 {} O 0.0 {0.397746200834 0.711582894037 0.521665295024} O1 4791 -1 8 {} O 0.0 {0.371864779503 0.703549994115 0.507594885007} O3 4792 -1 1 {} H 0.0 {0.376213716438 0.702563857788 0.498140258382} H2 4793 -1 8 {} O 0.0 {0.382975689255 0.684932352954 0.52606536047} O5 4794 -1 1 {} H 0.0 {0.376176255996 0.688307412294 0.533302993386} H4 4795 -1 8 {} O 0.0 {0.403665533131 0.694268727767 0.545742458254} O6 4796 -1 1 {} H 0.0 {0.411502285479 0.701009463354 0.547159866593} H5 4797 -1 8 {} O 0.0 {0.412210401698 0.68513581089 0.518542748778} O7 4798 -1 1 {} H 0.0 {0.421326027035 0.690223058363 0.519670978303} H6 4799 -1 1 {} H 0.0 {0.735282583858 0.454446583391 0.428558557873} H3 4800 -1 14 {} Si 0.0 {0.474741164468 0.534896942014 0.292933794278} Si1 4801 -1 8 {} O 0.0 {0.491678365663 0.538130655063 0.299291341239} O1 4802 -1 14 {} Si 0.0 {0.503639410825 0.527720244698 0.289996458016} Si2 4803 -1 8 {} O 0.0 {0.502209629855 0.531349481092 0.272020161002} O2 4804 -1 1 {} H 0.0 {0.497087321303 0.523506114317 0.267276288011} H1 4805 -1 8 {} O 0.0 {0.52074499994 0.531417116692 0.295668167453} O3 4806 -1 1 {} H 0.0 {0.522034617745 0.527812405524 0.305441632049} H2 4807 -1 8 {} O 0.0 {0.499870505291 0.509960555283 0.29297067644} O4 4808 -1 1 {} H 0.0 {0.491923223687 0.507000075832 0.286774940794} H3 4809 -1 8 {} O 0.0 {0.462490481124 0.54428964829 0.302944653468} O5 4810 -1 1 {} H 0.0 {0.465711180669 0.554227720203 0.303971795339} H4 4811 -1 8 {} O 0.0 {0.471124777747 0.516899517266 0.294090569879} O6 4812 -1 1 {} H 0.0 {0.475203651995 0.511985505776 0.285752216678} H5 4813 -1 8 {} O 0.0 {0.473705616094 0.540215649505 0.275358427435} O7 4814 -1 1 {} H 0.0 {0.477692458248 0.532693574035 0.269204507736} H6 4815 -1 14 {} Si 0.0 {0.502167167474 0.466227241917 0.390559126487} Si1 4816 -1 8 {} O 0.0 {0.48419780463 0.469914791906 0.391849962857} O1 4817 -1 14 {} Si 0.0 {0.481394109287 0.487808706106 0.388692508292} Si2 4818 -1 8 {} O 0.0 {0.497059072133 0.497054904819 0.391407281148} O2 4819 -1 1 {} H 0.0 {0.497563473826 0.500180823522 0.401422336564} H1 4820 -1 8 {} O 0.0 {0.475778646698 0.490178939446 0.371335352734} O3 4821 -1 1 {} H 0.0 {0.469175260868 0.482445581839 0.36872498147} H2 4822 -1 8 {} O 0.0 {0.468538007492 0.494100986731 0.400178967751} O4 4823 -1 1 {} H 0.0 {0.461415624588 0.499560921641 0.394765600201} H3 4824 -1 8 {} O 0.0 {0.507613185183 0.468289917363 0.373106005588} O5 4825 -1 1 {} H 0.0 {0.502724457177 0.461223102348 0.367071499003} H4 4826 -1 8 {} O 0.0 {0.505258826682 0.448918327312 0.395944250142} O6 4827 -1 1 {} H 0.0 {0.496185541799 0.444499086307 0.39884419871} H5 4828 -1 8 {} O 0.0 {0.511598868902 0.477786515643 0.401334106247} O7 4829 -1 1 {} H 0.0 {0.519719267197 0.472704224901 0.405634522011} H6 4830 -1 14 {} Si 0.0 {0.461683867404 0.379181908454 0.34315388856} Si1 4831 -1 8 {} O 0.0 {0.478882743399 0.375995676789 0.348508244045} O1 4832 -1 14 {} Si 0.0 {0.482201585398 0.358079414581 0.346533659212} Si2 4833 -1 8 {} O 0.0 {0.46748861563 0.348576047595 0.352160936382} O2 4834 -1 1 {} H 0.0 {0.463985283545 0.352607545839 0.361210928141} H1 4835 -1 8 {} O 0.0 {0.485449907462 0.354409078097 0.328811591677} O3 4836 -1 1 {} H 0.0 {0.494243168317 0.348781814094 0.327967891721} H2 4837 -1 8 {} O 0.0 {0.496798190881 0.353325254623 0.356617729542} O4 4838 -1 1 {} H 0.0 {0.493912393289 0.346155295955 0.363723802369} H3 4839 -1 8 {} O 0.0 {0.455011801944 0.363810698733 0.335446302074} O5 4840 -1 1 {} H 0.0 {0.44719902789 0.360074117701 0.341319356049} H4 4841 -1 8 {} O 0.0 {0.46145934063 0.392970908139 0.330927924063} O6 4842 -1 1 {} H 0.0 {0.456762834378 0.401357971378 0.335193800695} H5 4843 -1 8 {} O 0.0 {0.451409563258 0.383704884378 0.357723296202} O7 4844 -1 1 {} H 0.0 {0.455824751815 0.391803186847 0.362725975413} H6 4845 -1 1 {} H 0.0 {0.669456202839 0.377196583299 0.635698889939} H4 4846 -1 8 {} O 0.0 {0.666926505255 0.353287277116 0.613826972182} O6 4847 -1 1 {} H 0.0 {0.670290189652 0.35262196462 0.603918800329} H5 4848 -1 1 {} H 0.0 {0.68598778456 0.374936343478 0.607452190389} H6 4849 -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 1 0 0 0 2 1 0 0 3 2 0 0 4 3 0 0 5 2 0 0 6 5 0 0 7 2 0 0 8 7 0 0 9 0 0 0 10 9 0 0 11 0 0 0 12 11 0 0 13 0 0 0 14 13 0 0 16 15 0 0 17 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0 4275 4813 4800 {0 0 0} 0 4276 4814 4813 {0 0 0} 0 4277 4816 4815 {0 0 0} 0 4278 4817 4816 {0 0 0} 0 4279 4818 4817 {0 0 0} 0 4280 4819 4818 {0 0 0} 0 4281 4820 4817 {0 0 0} 0 4282 4821 4820 {0 0 0} 0 4283 4822 4817 {0 0 0} 0 4284 4823 4822 {0 0 0} 0 4285 4824 4815 {0 0 0} 0 4286 4825 4824 {0 0 0} 0 4287 4826 4815 {0 0 0} 0 4288 4827 4826 {0 0 0} 0 4289 4828 4815 {0 0 0} 0 4290 4829 4828 {0 0 0} 0 4291 4831 4830 {0 0 0} 0 4292 4832 4831 {0 0 0} 0 4293 4833 4832 {0 0 0} 0 4294 4834 4833 {0 0 0} 0 4295 4835 4832 {0 0 0} 0 4296 4836 4835 {0 0 0} 0 4297 4837 4832 {0 0 0} 0 4298 4838 4837 {0 0 0} 0 4299 4839 4830 {0 0 0} 0 4300 4840 4839 {0 0 0} 0 4301 4841 4830 {0 0 0} 0 4302 4842 4841 {0 0 0} 0 4303 4843 4830 {0 0 0} 0 4304 4844 4843 {0 0 0} 0 4305 4847 4846 {0 0 0} 0 @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 ? {} {} {} {}}} } } }