#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 {} {0.468765594148 0.228427238499 0.482181238963} O1 1 1 14 {} {0.332666389282 0.235712172777 0.571273644929} Si1 2 1 14 {} {0.589419765058 0.331149330451 0.43843281554} Si2 3 1 8 {} {0.522241623363 0.475628911591 0.399656178472} O2 4 1 8 {} {0.332957144497 0.37113852585 0.66158741777} O3 5 1 14 {} {0.276937926269 0.519805961247 0.701596249017} Si3 6 1 14 {} {0.521408464634 0.643213973509 0.404826019367} Si4 7 1 1 {} {0.331363483678 0.119702594735 0.664527927796} H1 8 1 1 {} {0.213561008106 0.233029669671 0.481043514973} H2 9 1 1 {} {0.654832784283 0.265075541075 0.324731902469} H3 10 1 1 {} {0.686985078587 0.342407016316 0.548663806515} H4 11 1 1 {} {0.128577667112 0.526259815745 0.703351277103} H5 12 1 1 {} {0.33964495226 0.564222352196 0.827781980849} H6 13 1 1 {} {0.394962598388 0.724318134449 0.401282736617} H7 14 1 1 {} {0.574296032013 0.686988774884 0.272007117175} H8 15 1 1 {} {0.594424544602 0.689850865272 0.525752197931} H10 16 1 8 {} {0.336094030487 0.613047161101 0.576737709744} O 17 1 1 {} {0.310947042463 0.702539928804 0.545624277269} 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