#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 {} {0.474703394249 0.229984411074 0.484798559952} O1 1 1 14 {} {0.330174405682 0.227499385399 0.566226583638} Si1 2 1 14 {} {0.59525190026 0.341953990158 0.458947961185} Si2 3 1 8 {} {0.534820162015 0.494685386945 0.475551217533} O2 4 1 8 {} {0.302737537675 0.364327151142 0.653580715484} O3 5 1 14 {} {0.259634816113 0.521067147209 0.665862858537} Si3 6 1 14 {} {0.547383444298 0.654348518056 0.435903723574} Si4 7 1 1 {} {0.336280944027 0.114514409877 0.662522151885} H1 8 1 1 {} {0.22526989755 0.204218410287 0.463133471492} H2 9 1 1 {} {0.649828047592 0.316036308256 0.319866989419} H3 10 1 1 {} {0.701950456645 0.315297582353 0.563018766961} H4 11 1 1 {} {0.131441494089 0.529256313973 0.742102154123} H5 12 1 1 {} {0.368922475576 0.587956434873 0.742421238603} H6 13 1 1 {} {0.448170324155 0.742151666487 0.508965983016} H7 14 1 1 {} {0.516123663408 0.660932665092 0.290364629248} H8 15 1 1 {} {0.680734695041 0.705786707147 0.478363604236} H10 16 1 8 {} {0.238439952224 0.585097153808 0.513809186698} O 17 1 1 {} {0.268218408035 0.677404285351 0.505618320988} 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