#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 {} {0.468481837053 0.260358260934 0.491145805231} O1 1 1 14 {} {0.325619906661 0.231280093325 0.566268849056} Si1 2 1 14 {} {0.6017838678 0.346785937239 0.450028951701} Si2 3 1 8 {} {0.56521223938 0.505700876994 0.436342924457} O2 4 1 8 {} {0.27979746282 0.352724945552 0.665775810069} O3 5 1 14 {} {0.232296215046 0.506197084425 0.698248868669} Si3 6 1 14 {} {0.589854540141 0.665253636798 0.404782686296} Si4 7 1 1 {} {0.344559942804 0.110721905882 0.651652879395} H1 8 1 1 {} {0.224596317458 0.211471669004 0.459565659554} H2 9 1 1 {} {0.651211265084 0.296555059853 0.3180642368} H3 10 1 1 {} {0.704601962104 0.329084460747 0.557595717729} H4 11 1 1 {} {0.107759642017 0.500184427344 0.780962140139} H5 12 1 1 {} {0.341973690726 0.575247167073 0.771706905104} H6 13 1 1 {} {0.470975948411 0.74250099595 0.451615717238} H7 14 1 1 {} {0.605944743488 0.683681609359 0.257344659636} H8 15 1 1 {} {0.712602269552 0.71173499699 0.476902191068} H10 16 1 8 {} {0.207536413168 0.57604122688 0.55062872328} O 17 1 1 {} {0.17527766152 0.666993385874 0.542425618255} 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