#MD System 2.0 @Title neb0_image06 @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 {} {0.469148343363 0.252296614026 0.48680287293} O1 1 1 14 {} {0.323698419436 0.223978867999 0.559054286367} Si1 2 1 14 {} {0.608358436063 0.339498297193 0.473027916794} Si2 3 1 8 {} {0.585950446383 0.49076974859 0.533408049711} O2 4 1 8 {} {0.252436218884 0.354241329059 0.631115301078} O3 5 1 14 {} {0.273354443955 0.514328805715 0.658267193616} Si3 6 1 14 {} {0.494726835606 0.610479773062 0.463618915558} Si4 7 1 1 {} {0.341569661696 0.124014441603 0.667113241667} H1 8 1 1 {} {0.238623478122 0.175228158632 0.448415703874} H2 9 1 1 {} {0.638480408931 0.352158636437 0.326279260779} H3 10 1 1 {} {0.718373828376 0.275896063808 0.549871299029} H4 11 1 1 {} {0.145513696449 0.568243232601 0.714117111418} H5 12 1 1 {} {0.380058688338 0.55499632602 0.753624450496} H6 13 1 1 {} {0.404261531347 0.784766544804 0.493180527631} H7 14 1 1 {} {0.472265474824 0.609770825916 0.319785286588} H8 15 1 1 {} {0.595671402279 0.723966530168 0.472885741882} H10 16 1 8 {} {0.328768087696 0.572923015483 0.513794038827} O 17 1 1 {} {0.338826677525 0.744960969854 0.466697151235} 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