#MD System 2.0 @Title neb0_image02 @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 {} {0.456694618428 0.266629841226 0.488455861481} O1 1 1 14 {} {0.326194518807 0.24055118994 0.583940203308} Si1 2 1 14 {} {0.583712869485 0.349755378867 0.427656170582} Si2 3 1 8 {} {0.533715661942 0.493212928495 0.365555926608} O2 4 1 8 {} {0.310913482318 0.356438064707 0.699129540521} O3 5 1 14 {} {0.242381665376 0.502780107231 0.732898935238} Si3 6 1 14 {} {0.563438852535 0.655173252405 0.356554593261} Si4 7 1 1 {} {0.345945628863 0.110427350921 0.652761623431} H1 8 1 1 {} {0.204945046993 0.238712318821 0.497425254448} H2 9 1 1 {} {0.642174261482 0.268170275088 0.318090343087} H3 10 1 1 {} {0.682076035657 0.375940181789 0.536927090485} H4 11 1 1 {} {0.0961055673851 0.485043744893 0.750826350053} H5 12 1 1 {} {0.311081157126 0.553649164347 0.855026655659} H6 13 1 1 {} {0.437660966552 0.720834148417 0.312203486895} H7 14 1 1 {} {0.673757046876 0.682745706902 0.260537611126} H8 15 1 1 {} {0.602670484653 0.70829500728 0.490967959196} H10 16 1 8 {} {0.255501040693 0.609375771266 0.60801681112} O 17 1 1 {} {0.341117466467 0.654783747422 0.594083398229} 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 14 6 0 0 16 5 0 2 15 6 0 0 4 1 0 0 3 2 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 14 6 {0 0 0} 0 4 16 5 {0 0 0} 0 5 15 6 {0 0 0} 0 6 4 1 {0 0 0} 0 7 3 2 {0 0 0} 0 8 5 11 {0 0 0} 0 9 7 1 {0 0 0} 0 10 8 1 {0 0 0} 0 11 6 3 {0 0 0} 0 12 5 4 {0 0 0} 0 13 10 2 {0 0 0} 0 14 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