#MD System 2.0 @Title neb0_image03 @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 {} {0.268268724874 0.475366207284 0.522047478109} N1 1 1 14 {} {0.337182568905 0.590126408228 0.542057378236} Si1 2 1 14 {} {0.153151537223 0.485934708239 0.49777848063} Si2 3 1 14 {} {0.313254265677 0.340234184624 0.526829917931} Si3 4 1 8 {} {0.410443664084 0.609322099877 0.439229367215} O 5 1 1 {} {0.27847768237 0.689563403482 0.555694426497} H1 6 1 1 {} {0.396096694922 0.571019783468 0.639818927538} H2 7 1 1 {} {0.128854876305 0.606412975055 0.495033839766} H3 8 1 1 {} {0.102039949564 0.428640538625 0.587788489314} H4 9 1 1 {} {0.128723177526 0.43322496455 0.38913758674} H5 10 1 1 {} {0.375544792222 0.319485135632 0.431863767124} H6 11 1 1 {} {0.237390777706 0.260025725555 0.519072968299} H7 12 1 1 {} {0.362855665909 0.322395655842 0.633162103489} H8 13 1 1 {} {0.386937728489 0.631306038826 0.367007219401} H10 14 1 7 {} {0.764563563967 0.478350189169 0.548766825338} N3 15 1 14 {} {0.725098943403 0.460954860905 0.412477672761} Si4 16 1 14 {} {0.867732344061 0.539486953396 0.576014151623} Si5 17 1 14 {} {0.700127673632 0.427695490069 0.659289888654} Si6 18 1 7 {} {0.612530450644 0.435880085958 0.415713561611} N4 19 1 1 {} {0.75005187382 0.563748132708 0.349345685523} H11 20 1 1 {} {0.766040244718 0.361324855391 0.357980418677} H12 21 1 1 {} {0.912549772581 0.562174432023 0.46695760141} H13 22 1 1 {} {0.926054360242 0.463957387006 0.642946140228} H14 23 1 1 {} {0.859001232827 0.646951306597 0.63817022043} H15 24 1 1 {} {0.616817213429 0.493257349918 0.677498413603} H16 25 1 1 {} {0.756744028149 0.438597046711 0.76153068159} H17 26 1 1 {} {0.675936540796 0.307924385365 0.644283531273} H18 27 1 1 {} {0.587192877488 0.364288572716 0.383394907676} H19 28 1 1 {} {0.564770727996 0.495319488295 0.425528916823} 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