#MD System 2.0 @Title neb0_image05 @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 {} {0.468563627105 0.282111414879 0.493714081128} O1 1 1 14 {} {0.325633422958 0.236746269515 0.558740536063} Si1 2 1 14 {} {0.617278436358 0.349021313465 0.474791599869} Si2 3 1 8 {} {0.613187218514 0.505015275012 0.52846333303} O2 4 1 8 {} {0.245962874386 0.366478418759 0.61973145644} O3 5 1 14 {} {0.227648493941 0.527068962969 0.649147459713} Si3 6 1 14 {} {0.578518101668 0.654138421697 0.466499499403} Si4 7 1 1 {} {0.346715277926 0.138854122823 0.669208465198} H1 8 1 1 {} {0.243336888663 0.178273696679 0.449025251648} H2 9 1 1 {} {0.648205896647 0.347906016232 0.329626164531} H3 10 1 1 {} {0.715539533336 0.2740666412 0.556803676949} H4 11 1 1 {} {0.120616811651 0.553882626055 0.749958587069} H5 12 1 1 {} {0.361189059892 0.566782345877 0.699584350208} H6 13 1 1 {} {0.548828622429 0.747162038451 0.579593472724} H7 14 1 1 {} {0.461596252151 0.646581472207 0.375248443132} H8 15 1 1 {} {0.698687155286 0.702973700301 0.388119075253} H10 16 1 8 {} {0.182554004269 0.613775227513 0.515599753229} O 17 1 1 {} {0.206024395517 0.581680199975 0.427203052603} 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