#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 {} {0.463295352735 0.257474442016 0.478312607115} O1 1 1 14 {} {0.327146618424 0.250537228641 0.569355827353} Si1 2 1 14 {} {0.596755867171 0.337389081813 0.426290911898} Si2 3 1 8 {} {0.556145898703 0.477201952323 0.35017970517} O2 4 1 8 {} {0.322857945549 0.373270141871 0.678139032047} O3 5 1 14 {} {0.2543921702 0.512728558631 0.733467035082} Si3 6 1 14 {} {0.539287489624 0.640673274057 0.360014690062} Si4 7 1 1 {} {0.32961338043 0.122151984176 0.644384794534} H1 8 1 1 {} {0.209763589697 0.259506390859 0.477987911108} H2 9 1 1 {} {0.665170805529 0.250406884855 0.327519214703} H3 10 1 1 {} {0.683663547051 0.369473999674 0.543084155568} H4 11 1 1 {} {0.107856987617 0.494010105821 0.750145300629} H5 12 1 1 {} {0.323317291198 0.542944761828 0.861896277209} H6 13 1 1 {} {0.404444257341 0.679107902562 0.311525653502} H7 14 1 1 {} {0.644756903446 0.707256080414 0.277871927543} H8 15 1 1 {} {0.554122323348 0.685406838807 0.502837445248} H10 16 1 8 {} {0.269606014441 0.637221415338 0.626257997491} O 17 1 1 {} {0.357889464498 0.675756743801 0.611787391019} 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