#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 {} {0.467886229249 0.240498152995 0.472520979718} O1 1 1 14 {} {0.32840541258 0.248867297423 0.559221539391} Si1 2 1 14 {} {0.598497492079 0.331269206012 0.4306720087} Si2 3 1 8 {} {0.551666591104 0.475144763454 0.36793368553} O2 4 1 8 {} {0.332403263116 0.379673922809 0.658575327132} O3 5 1 14 {} {0.264391758246 0.515186805259 0.722503096943} Si3 6 1 14 {} {0.529990824084 0.637948643252 0.374367894979} Si4 7 1 1 {} {0.319425482176 0.125612310584 0.642121387649} H1 8 1 1 {} {0.213094439154 0.26013743145 0.465466834998} H2 9 1 1 {} {0.671143416586 0.256927580876 0.324631539478} H3 10 1 1 {} {0.682502570376 0.356235052558 0.551441224978} H4 11 1 1 {} {0.119979966163 0.49018353255 0.746159112159} H5 12 1 1 {} {0.340840025927 0.545781415799 0.846686127452} H6 13 1 1 {} {0.387319532271 0.669961066975 0.345348566595} H7 14 1 1 {} {0.618980086643 0.702694503747 0.274171886587} H8 15 1 1 {} {0.566272404342 0.690880151808 0.510074802719} H10 16 1 8 {} {0.269482285852 0.644360792529 0.619164349624} O 17 1 1 {} {0.347804366969 0.701155318685 0.619997628811} 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