#MD System 2.0 @Title neb0_image05 @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 8 {} {0.469143605325 0.22887506202 0.483434933717} O1 1 1 14 {} {0.331480693224 0.228831837795 0.570085191508} Si1 2 1 14 {} {0.603308219445 0.311116236018 0.439159109012} Si2 3 1 8 {} {0.559526402942 0.461940428262 0.382639438441} O2 4 1 8 {} {0.331433114459 0.36779236577 0.669618380592} O3 5 1 14 {} {0.27899658212 0.519076135048 0.698855046483} Si3 6 1 14 {} {0.512569719523 0.621886546878 0.413084641459} Si4 7 1 1 {} {0.330430466379 0.114676758654 0.662567865116} H1 8 1 1 {} {0.215455847595 0.234566407003 0.47917776258} H2 9 1 1 {} {0.667097001107 0.237371813423 0.327186288755} H3 10 1 1 {} {0.695104313451 0.3280552536 0.555308473685} H4 11 1 1 {} {0.126904155624 0.509054544249 0.707454332212} H5 12 1 1 {} {0.344217532141 0.551924398474 0.832666317994} H6 13 1 1 {} {0.353983344986 0.78960923975 0.384515079474} H7 14 1 1 {} {0.552910893625 0.691972481656 0.285482335166} H8 15 1 1 {} {0.586838036876 0.678754128304 0.526968555696} H10 16 1 8 {} {0.326918720128 0.632389156857 0.575116971124} O 17 1 1 {} {0.323767497024 0.764625159342 0.537737275167} H14 18 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} {10 10 10 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{10 0 0} {0 10 0} {0 0 10}} {{0.1 0 0} {0 0.1 0} {0 0 0.1}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 1 0 0 0 2 0 0 0 14 6 0 0 16 5 0 2 15 6 0 0 4 1 0 0 3 2 0 0 7 1 0 0 8 1 0 0 6 3 0 0 5 4 0 0 10 2 0 0 9 2 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 0 1 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 6 {0 0 0} 0 3 16 5 {0 0 0} 0 4 15 6 {0 0 0} 0 5 4 1 {0 0 0} 0 6 3 2 {0 0 0} 0 7 7 1 {0 0 0} 0 8 8 1 {0 0 0} 0 9 6 3 {0 0 0} 0 10 5 4 {0 0 0} 0 11 10 2 {0 0 0} 0 12 9 2 {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