#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 {} {0.458917251184 0.262931770627 0.492926210247} O1 1 1 14 {} {0.324119820924 0.236798252062 0.582408833373} Si1 2 1 14 {} {0.582950107992 0.350088674699 0.431212063515} Si2 3 1 8 {} {0.530516756905 0.493441779363 0.371387875057} O2 4 1 8 {} {0.30737890773 0.350161349528 0.69901311015} O3 5 1 14 {} {0.260640374438 0.50405727845 0.733266459188} Si3 6 1 14 {} {0.559830660564 0.656183074939 0.363458805698} Si4 7 1 1 {} {0.339001788464 0.105303270796 0.64874185755} H1 8 1 1 {} {0.206472655349 0.239653101286 0.491829831} H2 9 1 1 {} {0.640520215859 0.269770190677 0.319273562269} H3 10 1 1 {} {0.683861364012 0.375224140809 0.539354523432} H4 11 1 1 {} {0.112251482961 0.514010731112 0.731010496101} H5 12 1 1 {} {0.318219549198 0.536624681697 0.865444541098} H6 13 1 1 {} {0.433227827884 0.72563563865 0.326071964864} H7 14 1 1 {} {0.661488523243 0.681608620505 0.256694018304} H8 15 1 1 {} {0.609132632169 0.70791009218 0.494417452469} H10 16 1 8 {} {0.32262191634 0.61052820801 0.622734237966} O 17 1 1 {} {0.258934372707 0.652587201147 0.561811933447} 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