#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 {} {0.466528933923 0.2373510817 0.489285276002} O1 1 1 14 {} {0.327966209737 0.228410447329 0.575993111494} Si1 2 1 14 {} {0.585243317219 0.340569597579 0.440829283972} Si2 3 1 8 {} {0.523105435983 0.48751045997 0.405641559622} O2 4 1 8 {} {0.317999910384 0.355296239003 0.680373883232} O3 5 1 14 {} {0.277335942187 0.512525728557 0.701028816194} Si3 6 1 14 {} {0.530972662402 0.653093933469 0.40180729896} Si4 7 1 1 {} {0.330752774425 0.10321229276 0.655867865283} H1 8 1 1 {} {0.210390076803 0.231050626141 0.484471593186} H2 9 1 1 {} {0.645120221794 0.280407521073 0.318530316171} H3 10 1 1 {} {0.685265681927 0.353348012825 0.551211927799} H4 11 1 1 {} {0.12983760556 0.528960188918 0.698414786136} H5 12 1 1 {} {0.340678934098 0.558457801025 0.82667378998} H6 13 1 1 {} {0.406400944479 0.735372736233 0.395922571093} H7 14 1 1 {} {0.593977357985 0.684456160629 0.269902842048} H8 15 1 1 {} {0.61291393297 0.702204738697 0.51695321421} H10 16 1 8 {} {0.338415096553 0.602910753171 0.576508808341} O 17 1 1 {} {0.28718103761 0.677379608318 0.541641054888} 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