#MD System 2.0 @Title neb0_image01 @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 7 {} {0.256500078412 0.48402336941 0.522883107264} N1 1 1 14 {} {0.325157648192 0.598901253999 0.543496131304} Si1 2 1 14 {} {0.14131554326 0.494569028904 0.498849691115} Si2 3 1 14 {} {0.301500737571 0.348834367526 0.527950282893} Si3 4 1 8 {} {0.398156060747 0.618556890339 0.44029879213} O 5 1 1 {} {0.266681460842 0.698493109356 0.556495057847} H1 6 1 1 {} {0.384427985042 0.57976728844 0.640959791811} H2 7 1 1 {} {0.117070831666 0.615134257028 0.496172791736} H3 8 1 1 {} {0.090161066553 0.437294817094 0.589017463096} H4 9 1 1 {} {0.11697795195 0.441947452101 0.390120684594} H5 10 1 1 {} {0.363736228674 0.328321218395 0.432904200486} H6 11 1 1 {} {0.22549231926 0.26873547259 0.519962412534} H7 12 1 1 {} {0.351111971009 0.331119248033 0.634344971423} H8 13 1 1 {} {0.375098370062 0.640113234986 0.367803175538} H10 14 1 7 {} {0.775657871316 0.470107844243 0.547790980591} N3 15 1 14 {} {0.736130987836 0.452694239782 0.411471732041} Si4 16 1 14 {} {0.878808533653 0.531342993228 0.574974837177} Si5 17 1 14 {} {0.711150708611 0.419569448496 0.658281086793} Si6 18 1 7 {} {0.623656517277 0.42759899143 0.414750273792} N4 19 1 1 {} {0.761034660716 0.555653561727 0.348373895274} H11 20 1 1 {} {0.777291054507 0.353083606428 0.35699754328} H12 21 1 1 {} {0.923541468511 0.554038424095 0.465881601295} H13 22 1 1 {} {0.937243688527 0.455787901221 0.642003866758} H14 23 1 1 {} {0.870020997544 0.638842537881 0.637225840238} H15 24 1 1 {} {0.627797507425 0.48512465001 0.676630136962} H16 25 1 1 {} {0.767760928507 0.430453269457 0.760618584935} H17 26 1 1 {} {0.686854678289 0.299732113694 0.643264124581} H18 27 1 1 {} {0.598487833873 0.356040206537 0.382407547177} H19 28 1 1 {} {0.575608260607 0.487087551461 0.424489965757} H20 29 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} {15 12 12 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{15 0 0} {0 12 0} {0 0 12}} {{0.0666666666667 0 0} {0 0.0833333333333 0} {0 0 0.0833333333333}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 27 18 0 0 2 0 0 0 15 14 0 0 10 3 0 0 6 1 0 0 26 17 0 0 7 2 0 0 8 2 0 0 21 16 0 0 28 18 0 0 9 2 0 0 20 15 0 0 19 15 0 0 1 0 0 0 4 1 0 0 5 1 0 0 25 17 0 0 18 15 0 0 13 4 0 0 3 0 0 0 16 14 0 0 17 14 0 0 12 3 0 0 24 17 0 0 23 16 0 0 11 3 0 0 22 16 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 27 18 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 15 {0 0 0} 0 3 3 10 {0 0 0} 0 4 1 6 {0 0 0} 0 5 26 17 {0 0 0} 0 6 7 2 {0 0 0} 0 7 8 2 {0 0 0} 0 8 16 21 {0 0 0} 0 9 28 18 {0 0 0} 0 10 9 2 {0 0 0} 0 11 15 20 {0 0 0} 0 12 15 19 {0 0 0} 0 13 0 1 {0 0 0} 0 14 4 1 {0 0 0} 0 15 1 5 {0 0 0} 0 16 17 25 {0 0 0} 0 17 15 18 {0 0 0} 0 18 4 13 {0 0 0} 0 19 3 0 {0 0 0} 0 20 16 14 {0 0 0} 0 21 14 17 {0 0 0} 0 22 3 12 {0 0 0} 0 23 17 24 {0 0 0} 0 24 16 23 {0 0 0} 0 25 11 3 {0 0 0} 0 26 22 16 {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