#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 {} {0.463944724032 0.246823599467 0.48603679831} O1 1 1 14 {} {0.326121471882 0.229508204172 0.573315854691} Si1 2 1 14 {} {0.587630332187 0.344037607288 0.443008147456} Si2 3 1 8 {} {0.532855950519 0.49673802452 0.412134079608} O2 4 1 8 {} {0.305417183107 0.353019196336 0.678179918899} O3 5 1 14 {} {0.260846937213 0.509605883691 0.705680215733} Si3 6 1 14 {} {0.549701376659 0.661418268133 0.401060682558} Si4 7 1 1 {} {0.335744113382 0.10435418831 0.652498897106} H1 8 1 1 {} {0.214843539346 0.221298660641 0.474661917513} H2 9 1 1 {} {0.647085683112 0.287563669891 0.320273369697} H3 10 1 1 {} {0.691450497651 0.348127310749 0.549501131902} H4 11 1 1 {} {0.113083896773 0.522213933168 0.727177655587} H5 12 1 1 {} {0.343040514943 0.554513386454 0.820715567681} H6 13 1 1 {} {0.421055274435 0.73345082396 0.412435206953} H7 14 1 1 {} {0.605019442263 0.690595981488 0.262944975195} H8 15 1 1 {} {0.645728369225 0.710766264238 0.506499955573} H10 16 1 8 {} {0.3074015412 0.592578053201 0.572736199438} O 17 1 1 {} {0.259115207209 0.665904806621 0.532197468467} 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