#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 {} {0.469739846402 0.2607586853 0.490543446331} O1 1 1 14 {} {0.326332126133 0.232237897936 0.566201688453} Si1 2 1 14 {} {0.603030744599 0.34621978596 0.450841183202} Si2 3 1 8 {} {0.565179979087 0.505311744553 0.440522213529} O2 4 1 8 {} {0.280663017585 0.353759691242 0.666265983571} O3 5 1 14 {} {0.231565110042 0.507805045059 0.69644565685} Si3 6 1 14 {} {0.59079760226 0.664191088008 0.406001202863} Si4 7 1 1 {} {0.344231602144 0.110880226853 0.652274347649} H1 8 1 1 {} {0.224355634217 0.209334560131 0.457377216225} H2 9 1 1 {} {0.651099278176 0.296983598848 0.319154056632} H3 10 1 1 {} {0.705701454896 0.327172305007 0.557095156716} H4 11 1 1 {} {0.108806622085 0.500327351667 0.78102564504} H5 12 1 1 {} {0.34253566378 0.577809744327 0.768021050242} H6 13 1 1 {} {0.473435791069 0.743152296723 0.455399622847} H7 14 1 1 {} {0.603798045856 0.683219675512 0.258317624962} H8 15 1 1 {} {0.715102041987 0.710876129637 0.474688332506} H10 16 1 8 {} {0.200991662319 0.574948688235 0.548783312014} O 17 1 1 {} {0.172719697685 0.667529219727 0.542100620613} 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