#MD System 2.0 @Title neb0_image01 @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 {} {0.462156891417 0.259875137587 0.48003416558} O1 1 1 14 {} {0.327262127226 0.248745801748 0.572541847471} Si1 2 1 14 {} {0.594914707833 0.339160676675 0.426373898471} Si2 3 1 8 {} {0.553990395715 0.478294174876 0.349671293743} O2 4 1 8 {} {0.32163446019 0.368385661529 0.684940788832} O3 5 1 14 {} {0.253958359372 0.511047194267 0.732317487122} Si3 6 1 14 {} {0.540590770184 0.642135668739 0.358658417167} Si4 7 1 1 {} {0.3327349579 0.118667668898 0.64394258241} H1 8 1 1 {} {0.208021204294 0.257472670659 0.483845527774} H2 9 1 1 {} {0.661806323294 0.251738525608 0.326876789617} H3 10 1 1 {} {0.682739900411 0.372203598474 0.542373585563} H4 11 1 1 {} {0.107143750451 0.493825805886 0.745513706057} H5 12 1 1 {} {0.320412828499 0.548024511228 0.8604357385} H6 13 1 1 {} {0.408194131198 0.682404697263 0.304120343547} H7 14 1 1 {} {0.651014869662 0.705304636347 0.281287770381} H8 15 1 1 {} {0.5518186655 0.688007705818 0.501126349901} H10 16 1 8 {} {0.272958745126 0.630989635508 0.620115843426} O 17 1 1 {} {0.358732818414 0.676233902424 0.616881761466} 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 12 5 0 0 1 0 0 0 2 0 0 0 16 5 0 0 4 1 0 0 3 2 0 0 17 16 0 0 11 5 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 12 5 {0 0 0} 0 1 0 1 {0 0 0} 0 2 0 2 {0 0 0} 0 3 16 5 {0 0 0} 0 4 4 1 {0 0 0} 0 5 3 2 {0 0 0} 0 6 16 17 {0 0 0} 0 7 5 11 {0 0 0} 0 8 7 1 {0 0 0} 0 9 8 1 {0 0 0} 0 10 6 3 {0 0 0} 0 11 5 4 {0 0 0} 0 12 10 2 {0 0 0} 0 13 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