#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 {} {0.467300764422 0.244556683465 0.473871407952} O1 1 1 14 {} {0.328149573128 0.249831800861 0.56098044379} Si1 2 1 14 {} {0.598634624323 0.332584947371 0.429764926388} Si2 3 1 8 {} {0.553507578588 0.475848425116 0.363793183904} O2 4 1 8 {} {0.330268400759 0.37950404862 0.661532548742} O3 5 1 14 {} {0.262152539002 0.514773353599 0.725683531531} Si3 6 1 14 {} {0.532226045201 0.638674099641 0.370919278103} Si4 7 1 1 {} {0.320748149747 0.126027520994 0.642935995145} H1 8 1 1 {} {0.213062156904 0.259547943888 0.466999049143} H2 9 1 1 {} {0.670239632499 0.25418386113 0.326157930515} H3 10 1 1 {} {0.683467146324 0.35819027744 0.549640271639} H4 11 1 1 {} {0.117536087111 0.491311023872 0.74806641995} H5 12 1 1 {} {0.336525762126 0.543223261758 0.85151506477} H6 13 1 1 {} {0.390819176412 0.67303475529 0.338601794278} H7 14 1 1 {} {0.623426303728 0.704738174778 0.273517122827} H8 15 1 1 {} {0.563537136685 0.688829711059 0.50876575356} H10 16 1 8 {} {0.267893215511 0.643937224772 0.62292195048} O 17 1 1 {} {0.350591818769 0.693720850437 0.615391313952} 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