#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 {} {0.465170770976 0.248128548081 0.487175986861} O1 1 1 14 {} {0.325784644255 0.230453698545 0.571927156682} Si1 2 1 14 {} {0.589134079461 0.3452556185 0.442744043656} Si2 3 1 8 {} {0.537456485153 0.497243514469 0.412160278745} O2 4 1 8 {} {0.300840459178 0.353561419954 0.677289628883} O3 5 1 14 {} {0.257604403636 0.5095951736 0.706503157646} Si3 6 1 14 {} {0.555252126602 0.660185143171 0.39874104276} Si4 7 1 1 {} {0.337757118328 0.105910348899 0.651968432745} H1 8 1 1 {} {0.215490740878 0.219911664916 0.472549366613} H2 9 1 1 {} {0.648388194045 0.289774997854 0.317949191947} H3 10 1 1 {} {0.691832770712 0.345212075085 0.552013425796} H4 11 1 1 {} {0.111787516711 0.519097753243 0.73506169044} H5 12 1 1 {} {0.342255925804 0.554312260638 0.820044162324} H6 13 1 1 {} {0.425840590678 0.733401478826 0.416292243382} H7 14 1 1 {} {0.606675614447 0.6912372314 0.262565530121} H8 15 1 1 {} {0.648900986028 0.710722250044 0.503102146186} H10 16 1 8 {} {0.298826251758 0.591735518257 0.570497342141} O 17 1 1 {} {0.251087370941 0.666779162272 0.532473234207} 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