#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 {} {0.468684137657 0.233056530978 0.480206551704} O1 1 1 14 {} {0.331830940241 0.240141395015 0.567940215004} Si1 2 1 14 {} {0.592031522002 0.330662081394 0.434889675534} Si2 3 1 8 {} {0.531413252403 0.474206269741 0.386563001263} O2 4 1 8 {} {0.333318682824 0.375144003479 0.659247864647} O3 5 1 14 {} {0.274240291334 0.519818177636 0.706416105607} Si3 6 1 14 {} {0.526493363432 0.641097729798 0.389005688767} Si4 7 1 1 {} {0.327755124313 0.121552696395 0.656548274428} H1 8 1 1 {} {0.214978985555 0.240692457795 0.476841160582} H2 9 1 1 {} {0.660848828548 0.258723306728 0.326786973731} H3 10 1 1 {} {0.685791745228 0.343775002224 0.548058417056} H4 11 1 1 {} {0.12567278731 0.513941786984 0.71931985489} H5 12 1 1 {} {0.340014025006 0.55784204664 0.834922089597} H6 13 1 1 {} {0.389127415856 0.69673331069 0.380013107721} H7 14 1 1 {} {0.598187865919 0.695369159518 0.267788377079} H8 15 1 1 {} {0.581830910736 0.687323156141 0.522543854203} H10 16 1 8 {} {0.31393166026 0.623850777611 0.583300527732} O 17 1 1 {} {0.313934579439 0.718588079044 0.590666245267} 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