#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 {} {0.467567530141 0.230401215975 0.484694872781} O1 1 1 14 {} {0.330682251315 0.231502709352 0.575008368901} Si1 2 1 14 {} {0.586142569098 0.33538194881 0.43804133627} Si2 3 1 8 {} {0.519710779352 0.481096048606 0.403545055973} O2 4 1 8 {} {0.32508130378 0.361878685102 0.675420372233} O3 5 1 14 {} {0.27926021957 0.517334839113 0.700073603017} Si3 6 1 14 {} {0.522024023203 0.646291565041 0.404612095071} Si4 7 1 1 {} {0.329581375265 0.112151879398 0.664088013438} H1 8 1 1 {} {0.213535377978 0.234225161486 0.483118337108} H2 9 1 1 {} {0.651094842545 0.278408616322 0.317316682751} H3 10 1 1 {} {0.681827192341 0.350240293903 0.550161664503} H4 11 1 1 {} {0.130570098707 0.528809936042 0.700130545894} H5 12 1 1 {} {0.338154821303 0.561982175124 0.829234178216} H6 13 1 1 {} {0.397031008913 0.72862796334 0.392567665348} H7 14 1 1 {} {0.587443202707 0.68279635648 0.274931485519} H8 15 1 1 {} {0.605027980771 0.694671346726 0.519148874947} H10 16 1 8 {} {0.34116402297 0.607267244015 0.576851410701} O 17 1 1 {} {0.304187526468 0.689449974869 0.542113422318} 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