#MD System 2.0 @Title neb0_image03 @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 {} {0.457481438222 0.266401529364 0.490831739391} O1 1 1 14 {} {0.324185978624 0.237996964211 0.582473220666} Si1 2 1 14 {} {0.582443822826 0.351351526064 0.430098235171} Si2 3 1 8 {} {0.532247875659 0.494804972788 0.369288860341} O2 4 1 8 {} {0.30554303856 0.34991168656 0.700192502064} O3 5 1 14 {} {0.257375466812 0.503882904543 0.737271674525} Si3 6 1 14 {} {0.564162547758 0.656289653287 0.361852517433} Si4 7 1 1 {} {0.340345202805 0.10555002737 0.649528618457} H1 8 1 1 {} {0.206073606279 0.23976490928 0.49019877308} H2 9 1 1 {} {0.640887785667 0.270657661199 0.320888186688} H3 10 1 1 {} {0.682591519555 0.376204355558 0.536942909277} H4 11 1 1 {} {0.108207682358 0.511166031323 0.735985365492} H5 12 1 1 {} {0.316998979698 0.536520229442 0.868755205098} H6 13 1 1 {} {0.43660533106 0.724453778777 0.325556721623} H7 14 1 1 {} {0.664951161232 0.68289377642 0.255407807739} H8 15 1 1 {} {0.613592537831 0.708873973533 0.491790010577} H10 16 1 8 {} {0.318042137691 0.616246013322 0.628796571921} O 17 1 1 {} {0.258350090172 0.639548068138 0.555198788451} 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