#MD System 2.0 @Title neb0_image05 @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 {} {0.469470764656 0.226263204059 0.482752551537} O1 1 1 14 {} {0.331640838928 0.232724594622 0.573722033132} Si1 2 1 14 {} {0.600999777953 0.315425673069 0.43836923641} Si2 3 1 8 {} {0.550280141224 0.468176246008 0.388618746428} O2 4 1 8 {} {0.331734303689 0.370117447982 0.66688334639} O3 5 1 14 {} {0.282399619597 0.526816298094 0.690658666379} Si3 6 1 14 {} {0.509190878116 0.631458450625 0.4148736309} Si4 7 1 1 {} {0.330707394011 0.112184582962 0.663285812796} H1 8 1 1 {} {0.214683261995 0.233213353718 0.478875808712} H2 9 1 1 {} {0.666730479509 0.23847477874 0.326900112994} H3 10 1 1 {} {0.695284441565 0.327970347996 0.555157369035} H4 11 1 1 {} {0.129685623302 0.512716719521 0.706537192093} H5 12 1 1 {} {0.341898543118 0.554052057666 0.829687945063} H6 13 1 1 {} {0.356870613043 0.783957614867 0.405071884526} H7 14 1 1 {} {0.547983257991 0.687714291245 0.285460069572} H8 15 1 1 {} {0.589379151378 0.678586956251 0.531682384887} H10 16 1 8 {} {0.333538641005 0.637165105101 0.569980155617} O 17 1 1 {} {0.327608411801 0.735500233016 0.522541047182} 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