#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 {} {0.459616237867 0.257626393443 0.492851041447} O1 1 1 14 {} {0.325222302007 0.234822022204 0.583084520022} Si1 2 1 14 {} {0.582055498647 0.347759754833 0.432616692989} Si2 3 1 8 {} {0.525580745846 0.490896787631 0.375684170064} O2 4 1 8 {} {0.310402953893 0.349379682649 0.698334639567} O3 5 1 14 {} {0.263576045843 0.505261989826 0.727728150235} Si3 6 1 14 {} {0.555611696646 0.653326412357 0.367472077889} Si4 7 1 1 {} {0.337122116131 0.102031253519 0.648782232376} H1 8 1 1 {} {0.208136447147 0.23976447196 0.491701790318} H2 9 1 1 {} {0.64147465958 0.27390295983 0.319336077137} H3 10 1 1 {} {0.683071134167 0.3741842057 0.537963953283} H4 11 1 1 {} {0.114830903699 0.518000833032 0.725086705853} H5 12 1 1 {} {0.322228249062 0.540423696217 0.85971214364} H6 13 1 1 {} {0.42546919887 0.719914196964 0.330403621895} H7 14 1 1 {} {0.659018392289 0.680586261482 0.260520501638} H8 15 1 1 {} {0.608731563044 0.710143511759 0.497146015909} H10 16 1 8 {} {0.324806571384 0.604974245363 0.611365862733} O 17 1 1 {} {0.263131479649 0.669519372692 0.57126761142} 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