#MD System 2.0 @Title neb0_image04 @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 {} {0.468161376563 0.261234712047 0.491556590475} O1 1 1 14 {} {0.326265537457 0.230284804033 0.566921823632} Si1 2 1 14 {} {0.600182716807 0.34769181892 0.449468985746} Si2 3 1 8 {} {0.564032462654 0.506246210884 0.432963021371} O2 4 1 8 {} {0.279542614132 0.351093831814 0.666661530409} O3 5 1 14 {} {0.234554958699 0.503987146811 0.698835031998} Si3 6 1 14 {} {0.588643307843 0.665438706308 0.403564957827} Si4 7 1 1 {} {0.344130122548 0.109347734024 0.650243732016} H1 8 1 1 {} {0.223516112516 0.213364596162 0.462477965258} H2 9 1 1 {} {0.649936526497 0.296248130428 0.318735247083} H3 10 1 1 {} {0.70242843699 0.332121359642 0.556491245761} H4 11 1 1 {} {0.107235351045 0.501750012557 0.777704252673} H5 12 1 1 {} {0.34186819379 0.572280057134 0.776613760256} H6 13 1 1 {} {0.468015037165 0.741642778178 0.447110756185} H7 14 1 1 {} {0.608424980391 0.684419917866 0.257341801071} H8 15 1 1 {} {0.708224482 0.7129660652 0.478676393004} H10 16 1 8 {} {0.216095513824 0.576576549156 0.552081519904} O 17 1 1 {} {0.178828198365 0.665823318244 0.543609708034} 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