#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 {} {0.468092172322 0.261448557885 0.491842701143} O1 1 1 14 {} {0.326082660424 0.23036327445 0.567027107392} Si1 2 1 14 {} {0.600261015497 0.347768062396 0.449663899124} Si2 3 1 8 {} {0.564044511048 0.506249064366 0.433693430276} O2 4 1 8 {} {0.279332781445 0.350927204635 0.666721920157} O3 5 1 14 {} {0.234094677228 0.503911811673 0.69872203227} Si3 6 1 14 {} {0.588997958162 0.665745882355 0.403577411341} Si4 7 1 1 {} {0.344204808796 0.109416778651 0.650165373437} H1 8 1 1 {} {0.223839497402 0.213079203276 0.462228259697} H2 9 1 1 {} {0.650079281031 0.296503525078 0.318432257571} H3 10 1 1 {} {0.702869352785 0.331615062967 0.556854657592} H4 11 1 1 {} {0.107351721267 0.501549532828 0.778241739325} H5 12 1 1 {} {0.341950307644 0.572707913446 0.77545691009} H6 13 1 1 {} {0.469087848329 0.741948524896 0.448122129073} H7 14 1 1 {} {0.608743241266 0.684240536208 0.256962095674} H8 15 1 1 {} {0.709535767814 0.713163413797 0.478167759957} H10 16 1 8 {} {0.214126808656 0.576260446123 0.551514822252} O 17 1 1 {} {0.177391515923 0.665618951678 0.543663822208} 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