#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 {} {0.463700858179 0.256844274817 0.477941722377} O1 1 1 14 {} {0.327316189536 0.250984668411 0.568646572233} Si1 2 1 14 {} {0.596890809724 0.337049036084 0.426441707642} Si2 3 1 8 {} {0.55643259209 0.476908259426 0.350757356024} O2 4 1 8 {} {0.323395014384 0.374321021697 0.676661832975} O3 5 1 14 {} {0.254719867623 0.512779709615 0.733492438317} Si3 6 1 14 {} {0.539221062328 0.640336360341 0.360633563608} Si4 7 1 1 {} {0.328901176703 0.123129800147 0.644193177242} H1 8 1 1 {} {0.210127922811 0.259453258796 0.477131814079} H2 9 1 1 {} {0.665542938413 0.250355833016 0.32780052221} H3 10 1 1 {} {0.683745516631 0.368799357695 0.543172796183} H4 11 1 1 {} {0.108361642823 0.494253172911 0.750717039173} H5 12 1 1 {} {0.323895936867 0.542062562293 0.861824285443} H6 13 1 1 {} {0.403409294247 0.678720038866 0.31325018393} H7 14 1 1 {} {0.6430435276 0.707352026216 0.277403962237} H8 15 1 1 {} {0.5547663667 0.68504753667 0.503231034471} H10 16 1 8 {} {0.269228578107 0.638130293383 0.627001855205} O 17 1 1 {} {0.357386607726 0.675990594409 0.610756017665} 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