#MD System 2.0 @Title neb0_image05 @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 {} {0.473881176591 0.244874696004 0.48888478357} O1 1 1 14 {} {0.327229316819 0.227647286459 0.56137944989} Si1 2 1 14 {} {0.602586433666 0.343361602943 0.467973572296} Si2 3 1 8 {} {0.559865408061 0.499439487677 0.500692132771} O2 4 1 8 {} {0.279428516199 0.363954544338 0.63780285571} O3 5 1 14 {} {0.242529605066 0.522837523987 0.662827080774} Si3 6 1 14 {} {0.566162344013 0.6540813552 0.444061662535} Si4 7 1 1 {} {0.338931391587 0.118861311396 0.661546883705} H1 8 1 1 {} {0.22659059309 0.190702486505 0.457957176272} H2 9 1 1 {} {0.645323487951 0.337424730477 0.325877277164} H3 10 1 1 {} {0.710463345345 0.306219011315 0.562944036967} H4 11 1 1 {} {0.133822919573 0.521706097548 0.768287691825} H5 12 1 1 {} {0.367606295065 0.596603389508 0.702371799069} H6 13 1 1 {} {0.479434877839 0.729776124368 0.541308376564} H7 14 1 1 {} {0.508444949912 0.66391790095 0.305200467792} H8 15 1 1 {} {0.707057414101 0.705802556294 0.437685645142} H10 16 1 8 {} {0.183213414492 0.597379520459 0.526312429709} O 17 1 1 {} {0.257514517605 0.647928367671 0.477944852765} 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