#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 {} {0.464276996606 0.247203404528 0.486240538716} O1 1 1 14 {} {0.325240066358 0.230947332689 0.573068000102} Si1 2 1 14 {} {0.588944974539 0.345148980415 0.443010104211} Si2 3 1 8 {} {0.535457710892 0.496038528092 0.412259424997} O2 4 1 8 {} {0.302755566359 0.354319715358 0.677210140778} O3 5 1 14 {} {0.258374773498 0.509152443121 0.706962873803} Si3 6 1 14 {} {0.553798993293 0.660002488829 0.399448535102} Si4 7 1 1 {} {0.337141937991 0.105311927308 0.652248709491} H1 8 1 1 {} {0.215886708473 0.220057625719 0.472939008465} H2 9 1 1 {} {0.648071802826 0.289426971013 0.319144232839} H3 10 1 1 {} {0.691731818459 0.345962716253 0.550568878933} H4 11 1 1 {} {0.111641108718 0.52025571199 0.732655285701} H5 12 1 1 {} {0.342669730499 0.554158278489 0.81974975724} H6 13 1 1 {} {0.422645437117 0.733946850423 0.415574458873} H7 14 1 1 {} {0.606543979549 0.691378843544 0.261814865661} H8 15 1 1 {} {0.648859522041 0.711315600208 0.505007975363} H10 16 1 8 {} {0.301531037554 0.59192514712 0.571310643641} O 17 1 1 {} {0.254513884627 0.665965292854 0.531844620506} 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