#MD System 2.0 @Title neb0_image08 @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} Fractional double {{0.0 0.0 0.0}} Name string {{}} Site int 1 WyckoffPosition int -1 @end @data 6 {} {0.32500636623 0.508553103728 0.505273583399} C1 1 1 14 {} {0.365457107415 0.462245868071 0.464630417546} Si1 2 1 14 {} {0.288571275869 0.515654649861 0.427906493956} Si2 3 1 8 {} {0.384848850978 0.446789317958 0.344469354657} O1 4 1 8 {} {0.356839367425 0.563417801139 0.582265179895} O2 5 1 6 {} {0.384216810485 0.367707537043 0.478016318601} C2 6 1 6 {} {0.25538287708 0.437208623351 0.412689796888} C3 7 1 8 {} {0.31534315587 0.578519602094 0.357386713669} O3 8 1 8 {} {0.251307940546 0.551015413769 0.495059635532} O4 9 1 14 {} {0.425774774996 0.518513381182 0.488825355305} Si3 10 1 7 {} {0.331850102801 0.300661139675 0.488737087789} N1 11 1 14 {} {0.18031354124 0.191561644494 -0.290894137776} Si4 12 1 14 {} {0.447233870291 0.359561003517 0.713688280427} Si5 13 1 7 {} {0.437519245101 0.421726182549 0.829164508713} N2 14 1 7 {} {-0.602223127293 0.840226493666 -1.44223754699} N3 15 1 1 {} {0.321424640938 0.478821667812 0.568059311288} H1 16 1 1 {} {0.351982583538 0.556390486658 0.522921450637} H2 17 1 1 {} {0.374814560742 0.52281618728 0.322285307218} H3 18 1 1 {} {0.375060459613 0.335401404907 0.532222855504} H4 19 1 1 {} {0.413366680221 0.339922181064 0.455358052886} H5 20 1 1 {} {0.357732556877 0.361683584285 0.430598314634} H6 21 1 1 {} {0.228979491988 0.452488903173 0.366183015082} H7 22 1 1 {} {0.236994058829 0.431592525052 0.480635979711} H8 23 1 1 {} {0.269823441299 0.385521809155 0.397104524817} H9 24 1 1 {} {0.279839308169 0.571947464678 0.299672804162} H10 25 1 1 {} {0.218380279777 0.529065440619 0.510106535645} H11 26 1 1 {} {0.41575226055 0.516811037731 0.417631572227} H12 27 1 1 {} {0.494097488833 0.56286217207 0.611384006765} H13 28 1 1 {} {0.566832195787 0.856239943965 0.215384237441} H14 29 1 1 {} {0.422325169523 -0.209948622404 -0.0743350099513} H15 30 1 1 {} {0.421535312762 0.25684245781 0.710634798671} H16 31 1 1 {} {0.529360947469 0.367991868986 0.696383668009} H17 32 1 1 {} {0.426816432864 0.46521138022 0.769982291271} H18 33 1 1 {} {0.456492762615 0.477690310817 0.817014259877} H19 34 1 1 {} {0.0619563650945 0.391758359514 0.0372083089409} H20 35 1 1 {} {-1.21835832196 0.898164142028 -1.38714606389} H21 36 1 6 {} {0.888580226167 0.765224609538 0.30759800793} C4 37 1 14 {} {0.908180698443 0.743866736262 0.639357625768} Si6 38 1 14 {} {0.601121676852 0.802193586801 0.218371271788} Si7 39 1 8 {} {0.343106316013 0.698394930424 0.665328266947} O5 40 1 8 {} {0.681860094736 0.51099905227 0.258165253152} O6 41 1 6 {} {1.16601654084 0.7888564902 1.65379161083} C5 42 1 6 {} {0.492379683363 0.778406430328 0.283852439958} C6 43 1 8 {} {0.55868150771 0.736479603141 0.123080087697} O7 44 1 8 {} {0.613556274293 0.945258824404 0.199011677928} O8 45 1 14 {} {0.552017838765 0.411298117984 0.279363850002} Si8 46 1 7 {} {0.472095846878 0.38274231715 0.238704388957} N4 47 1 14 {} {0.459743700054 0.340788442073 0.208640335341} Si9 48 1 14 {} {0.468631920649 0.370586123026 0.436903428256} Si10 49 1 7 {} {0.514075076825 0.38631142452 0.417130123892} N5 50 1 7 {} {0.475151094507 0.248527078978 0.0950883746161} N6 51 1 1 {} {0.649839527502 0.684721619872 0.303741500533} H22 52 1 1 {} {0.947811340554 0.893522467476 0.411772315768} H23 53 1 1 {} {0.391813521744 0.568761987681 0.21424394599} H24 54 1 1 {} {1.06184735941 1.10448565205 1.82343387804} H25 55 1 1 {} {1.8571424651 0.000576051092107 1.95847146413} H26 56 1 1 {} {0.730869689616 0.26708527664 0.836108210539} H27 57 1 1 {} {0.482052086581 0.835718086644 0.25082405151} H28 58 1 1 {} {0.484574610122 0.804463885931 0.357790426432} H29 59 1 1 {} {0.450233674283 0.775847301274 0.271624582839} H30 60 1 1 {} {0.521207491484 0.769348105034 0.0526072777889} H31 61 1 1 {} {0.587209956945 0.896287716559 0.330913956834} H32 62 1 1 {} {0.530185648268 0.41833493823 0.126725887443} H33 63 1 1 {} {0.585934216622 0.386519008294 0.319682581458} H34 64 1 1 {} {0.413210149961 0.30589858181 0.221390739949} H35 65 1 1 {} {0.441816342655 0.388964217646 0.122303454088} H36 66 1 1 {} {0.445531935763 0.434956990624 0.585784081631} H37 67 1 1 {} {0.429864843825 0.290397935527 0.392102697757} H38 68 1 1 {} {0.483500123419 0.434035700029 0.491339973964} H39 69 1 1 {} {0.544975409497 0.372806604094 0.515805378441} H40 70 1 1 {} {0.498451091375 0.288484434907 0.0775562369035} H41 71 1 1 {} {0.481756884888 0.223515929482 0.126926198657} H42 72 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} {30 20 15 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{30 0 0} {0 20 0} {0 0 15}} {{0.0333333333333 0 0} {0 0.05 0} {0 0 0.0666666666667}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 56 41 0 0 50 47 0 0 2 0 0 0 58 42 0 0 44 38 0 0 70 50 0 0 69 49 0 0 34 14 0 0 48 46 0 0 52 36 0 0 6 2 0 0 49 48 0 0 62 45 0 0 21 6 0 0 7 2 0 0 22 6 0 0 8 2 0 0 27 9 0 0 33 13 0 0 37 36 0 0 23 6 0 0 59 42 0 0 12 10 0 0 54 41 0 0 51 36 0 0 61 44 0 0 16 0 0 0 19 5 0 0 20 5 0 0 13 12 0 0 1 0 0 0 43 38 0 0 10 9 0 0 68 49 0 0 53 39 0 0 3 1 0 0 47 46 0 0 60 43 0 0 4 1 0 0 18 5 0 0 5 1 0 0 67 48 0 0 26 9 0 0 32 13 0 0 46 45 0 0 17 3 0 0 11 10 0 0 9 4 0 0 15 0 0 0 25 8 0 0 31 12 0 0 42 38 0 0 64 47 0 0 24 7 0 0 29 11 0 0 40 37 0 0 39 37 0 0 41 37 0 0 66 48 0 0 57 42 0 0 38 36 0 0 65 47 0 0 30 12 0 0 28 11 0 0 71 50 0 0 45 40 0 0 35 14 0 0 55 41 0 0 14 11 0 0 63 45 0 0 @end @Columns Bond AsymmetricBond reference AsymmetricBond Atom1 reference Atom Atom2 reference Atom CellOffset2 int {{0 0 0}} Key int 0 @end @data 0 56 41 {0 0 0} 0 1 47 50 {0 0 0} 0 2 0 2 {0 0 0} 0 3 58 42 {0 0 0} 0 4 38 44 {0 0 0} 0 5 50 70 {0 0 0} 0 6 49 69 {0 0 0} 0 7 14 34 {0 0 0} 0 8 46 48 {0 0 0} 0 9 36 52 {0 0 0} 0 10 2 6 {0 0 0} 0 11 48 49 {0 0 0} 0 12 45 62 {0 0 0} 0 13 21 6 {0 0 0} 0 14 7 2 {0 0 0} 0 15 22 6 {0 0 0} 0 16 8 2 {0 0 0} 0 17 9 27 {0 0 0} 0 18 13 33 {0 0 0} 0 19 36 37 {0 0 0} 0 20 23 6 {0 0 0} 0 21 59 42 {0 0 0} 0 22 10 12 {0 0 0} 0 23 41 54 {0 0 0} 0 24 51 36 {0 0 0} 0 25 44 61 {0 0 0} 0 26 0 16 {0 0 0} 0 27 5 19 {0 0 0} 0 28 5 20 {0 0 0} 0 29 12 13 {0 0 0} 0 30 0 1 {0 0 0} 0 31 38 43 {0 0 0} 0 32 10 9 {0 0 0} 0 33 49 68 {0 0 0} 0 34 39 53 {0 0 0} 0 35 3 1 {0 0 0} 0 36 46 47 {0 0 0} 0 37 43 60 {0 0 0} 0 38 4 1 {0 0 0} 0 39 18 5 {0 0 0} 0 40 1 5 {0 0 0} 0 41 48 67 {0 0 0} 0 42 9 26 {0 0 0} 0 43 13 32 {0 0 0} 0 44 45 46 {0 0 0} 0 45 3 17 {0 0 0} 0 46 10 11 {0 0 0} 0 47 4 9 {0 0 0} 0 48 15 0 {0 0 0} 0 49 8 25 {0 0 0} 0 50 12 31 {0 0 0} 0 51 38 42 {0 0 0} 0 52 64 47 {0 0 0} 0 53 7 24 {0 0 0} 0 54 11 29 {0 0 0} 0 55 40 37 {0 0 0} 0 56 39 37 {0 0 0} 0 57 37 41 {0 0 0} 0 58 66 48 {0 0 0} 0 59 42 57 {0 0 0} 0 60 38 36 {0 0 0} 0 61 65 47 {0 0 0} 0 62 30 12 {0 0 0} 0 63 28 11 {0 0 0} 0 64 50 71 {0 0 0} 0 65 45 40 {0 0 0} 0 66 14 35 {0 0 0} 0 67 55 41 {0 0 0} 0 68 11 14 {0 0 0} 0 69 63 45 {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