#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 {} {0.470330939072 0.273061708835 0.492853375444} O1 1 1 14 {} {0.325394988752 0.235331274303 0.557167658725} Si1 2 1 14 {} {0.61452086517 0.349555173627 0.475174810237} Si2 3 1 8 {} {0.607083458689 0.505356257731 0.527916289388} O2 4 1 8 {} {0.249010710348 0.364354265353 0.622586866668} O3 5 1 14 {} {0.233295769592 0.525562054866 0.650736175197} Si3 6 1 14 {} {0.580162696997 0.655160925574 0.464436888694} Si4 7 1 1 {} {0.342708345101 0.139399442616 0.668680477453} H1 8 1 1 {} {0.243335853122 0.178091985693 0.447155060943} H2 9 1 1 {} {0.645831263873 0.349620127983 0.328639021841} H3 10 1 1 {} {0.714259528479 0.27734349887 0.557959891506} H4 11 1 1 {} {0.129116814967 0.548652492834 0.752805587254} H5 12 1 1 {} {0.365401330701 0.573802876145 0.702610223274} H6 13 1 1 {} {0.542387973586 0.748591866234 0.574739232929} H7 14 1 1 {} {0.469559677074 0.64764552672 0.363637823269} H8 15 1 1 {} {0.701125114062 0.702260358017 0.393582376235} H10 16 1 8 {} {0.171839827414 0.606077429825 0.520358896456} O 17 1 1 {} {0.204720905005 0.592650881278 0.430017562797} 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