#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 8 {} {0.465421315851 0.243028447356 0.487166866799} O1 1 1 14 {} {0.328372093252 0.235206521919 0.576323484228} Si1 2 1 14 {} {0.586620276551 0.339809583432 0.433432340382} Si2 3 1 8 {} {0.526614497107 0.484026652295 0.383751443031} O2 4 1 8 {} {0.319606533275 0.359019150921 0.683525189299} O3 5 1 14 {} {0.269129284377 0.511693615123 0.716483600674} Si3 6 1 14 {} {0.540794976503 0.64806037128 0.377845306957} Si4 7 1 1 {} {0.331452966256 0.108603958093 0.654027904073} H1 8 1 1 {} {0.209968152785 0.23974970803 0.486150842675} H2 9 1 1 {} {0.648889847077 0.269880914683 0.31798283057} H3 10 1 1 {} {0.682977813517 0.363719394776 0.544817471869} H4 11 1 1 {} {0.120188748911 0.51563852358 0.723335728548} H5 12 1 1 {} {0.330377340835 0.551842618881 0.846192178412} H6 13 1 1 {} {0.408759180201 0.712425556095 0.349074429558} H7 14 1 1 {} {0.634673776146 0.680984141109 0.266135810068} H8 15 1 1 {} {0.596679842842 0.702792760523 0.505824750443} H10 16 1 8 {} {0.322772076339 0.608077973536 0.592073059489} O 17 1 1 {} {0.286787423228 0.697958114873 0.58691467809} 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