#MD System 2.0 @Title neb0_image02 @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 {} {0.262340963464 0.479560327144 0.52253416298} N1 1 1 14 {} {0.331367540669 0.594649581442 0.542266263387} Si1 2 1 14 {} {0.147332708631 0.490212441553 0.498361924604} Si2 3 1 14 {} {0.307335901494 0.344648441298 0.527362005401} Si3 4 1 8 {} {0.404118946165 0.613992720382 0.439886472426} O 5 1 1 {} {0.272510836168 0.694053674185 0.556175516535} H1 6 1 1 {} {0.390248757126 0.575381462985 0.640444109378} H2 7 1 1 {} {0.122963345345 0.610735908388 0.495607842468} H3 8 1 1 {} {0.0962021822762 0.43298983407 0.58832259614} H4 9 1 1 {} {0.122832807177 0.437583685711 0.389616644749} H5 10 1 1 {} {0.369637265412 0.323890511165 0.432403331068} H6 11 1 1 {} {0.231454223216 0.26439252727 0.519533173528} H7 12 1 1 {} {0.3569793441 0.326736081818 0.63377163053} H8 13 1 1 {} {0.381004541206 0.6356526118 0.367555369275} H10 14 1 7 {} {0.770059564569 0.474221673626 0.548124089237} N3 15 1 14 {} {0.730851007186 0.457043312616 0.41209460314} Si4 16 1 14 {} {0.873268006036 0.535401496875 0.575662812844} Si5 17 1 14 {} {0.705626055677 0.423556035429 0.658900939078} Si6 18 1 7 {} {0.617881691626 0.431721241512 0.415210051263} N4 19 1 1 {} {0.755525957874 0.55962898328 0.348882257556} H11 20 1 1 {} {0.771629751793 0.357206221346 0.357492816971} H12 21 1 1 {} {0.918061813727 0.558091967889 0.466381015987} H13 22 1 1 {} {0.931514050565 0.459939144793 0.64242293915} H14 23 1 1 {} {0.864511219288 0.642878792845 0.637655828647} H15 24 1 1 {} {0.622325073654 0.489188351831 0.677034253638} H16 25 1 1 {} {0.762234447105 0.434512600294 0.761034766618} H17 26 1 1 {} {0.681407655652 0.303869012482 0.643774824372} H18 27 1 1 {} {0.592835325013 0.360181558919 0.38291934102} H19 28 1 1 {} {0.57037297326 0.491048150464 0.424988995455} 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