#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 {} {0.469848387538 0.232069041271 0.47944319259} O1 1 1 14 {} {0.331571682092 0.241096568916 0.568051596798} Si1 2 1 14 {} {0.595606578956 0.329711927172 0.433568963673} Si2 3 1 8 {} {0.540293981831 0.477831640029 0.383023122545} O2 4 1 8 {} {0.332325095239 0.376292538843 0.6600095342} O3 5 1 14 {} {0.274011400563 0.522005360605 0.709610752246} Si3 6 1 14 {} {0.519873984017 0.642808147844 0.389599178335} Si4 7 1 1 {} {0.326101886539 0.118744773424 0.654971530696} H1 8 1 1 {} {0.214777201488 0.242693549188 0.474460904363} H2 9 1 1 {} {0.666896420117 0.246529744028 0.328985295629} H3 10 1 1 {} {0.689745719232 0.336826337891 0.552298925763} H4 11 1 1 {} {0.1281667501 0.507912630331 0.719635199369} H5 12 1 1 {} {0.341345696902 0.550348521774 0.837347861893} H6 13 1 1 {} {0.388343108422 0.711965405394 0.37502375864} H7 14 1 1 {} {0.588760000614 0.696467895444 0.270714145989} H8 15 1 1 {} {0.573991178949 0.6811961697 0.519839324907} H10 16 1 8 {} {0.30985693985 0.629339079588 0.588009076382} O 17 1 1 {} {0.318570116145 0.728678637741 0.5864656262} 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