#MD System 2.0 @Title neb0_image01 @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 {} {0.462713736567 0.259528019 0.479640089291} O1 1 1 14 {} {0.327286283714 0.2492804143 0.571407350575} Si1 2 1 14 {} {0.595684232694 0.338533572125 0.426136038551} Si2 3 1 8 {} {0.55501495272 0.477812839755 0.34960621978} O2 4 1 8 {} {0.321750104048 0.369922020061 0.682620263751} O3 5 1 14 {} {0.253913009424 0.511390487523 0.732906338534} Si3 6 1 14 {} {0.54020751587 0.641417869164 0.358787668748} Si4 7 1 1 {} {0.331723888143 0.119856179279 0.644212341965} H1 8 1 1 {} {0.208593394924 0.258457743922 0.481964790742} H2 9 1 1 {} {0.662963176038 0.251336628419 0.326861037023} H3 10 1 1 {} {0.68274561847 0.371603935684 0.54235827689} H4 11 1 1 {} {0.107113270345 0.494173835118 0.747251441192} H5 12 1 1 {} {0.321354493488 0.546641533641 0.860860477663} H6 13 1 1 {} {0.406764500761 0.680839832612 0.306418128299} H7 14 1 1 {} {0.649349917587 0.706032057342 0.280440470554} H8 15 1 1 {} {0.552691877891 0.686840448868 0.501328914392} H10 16 1 8 {} {0.271599924675 0.633210114351 0.622920874988} O 17 1 1 {} {0.358616003134 0.675640188787 0.61533716468} 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 12 5 0 0 1 0 0 0 2 0 0 0 16 5 0 0 4 1 0 0 3 2 0 0 17 16 0 0 11 5 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 12 5 {0 0 0} 0 1 0 1 {0 0 0} 0 2 0 2 {0 0 0} 0 3 16 5 {0 0 0} 0 4 4 1 {0 0 0} 0 5 3 2 {0 0 0} 0 6 16 17 {0 0 0} 0 7 5 11 {0 0 0} 0 8 7 1 {0 0 0} 0 9 8 1 {0 0 0} 0 10 6 3 {0 0 0} 0 11 5 4 {0 0 0} 0 12 10 2 {0 0 0} 0 13 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