#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 {} {0.46777302754 0.229401553298 0.483694526686} O1 1 1 14 {} {0.330639055659 0.232009291033 0.574059994777} Si1 2 1 14 {} {0.5865458783 0.333854741695 0.43816554969} Si2 3 1 8 {} {0.52041256238 0.479934705444 0.402740714664} O2 4 1 8 {} {0.326368598971 0.363532667472 0.673643624531} O3 5 1 14 {} {0.278635978511 0.517387984405 0.700915416072} Si3 6 1 14 {} {0.522508516551 0.645617455243 0.404954986791} Si4 7 1 1 {} {0.330065793719 0.11433239095 0.664707278483} H1 8 1 1 {} {0.213183332989 0.234107589977 0.48230255605} H2 9 1 1 {} {0.651838104051 0.27685106623 0.317552556276} H3 10 1 1 {} {0.682746761003 0.350111220935 0.550232590257} H4 11 1 1 {} {0.129867916506 0.528272839905 0.701255448428} H5 12 1 1 {} {0.338154286647 0.562511841967 0.829508696885} H6 13 1 1 {} {0.396207821791 0.727418800987 0.392977815246} H7 14 1 1 {} {0.585180672624 0.683213649047 0.275735549836} H8 15 1 1 {} {0.60409488212 0.693900913933 0.519448663831} H10 16 1 8 {} {0.340518926539 0.607651190665 0.576864912534} O 17 1 1 {} {0.305344010529 0.692408059806 0.542297109965} 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