#MD System 2.0 @Title neb0_image03 @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 {} {0.460774545651 0.256252287023 0.492331287817} O1 1 1 14 {} {0.325822055988 0.234273449462 0.582172436911} Si1 2 1 14 {} {0.581669877399 0.347918091674 0.431854690247} Si2 3 1 8 {} {0.524743991294 0.491601507404 0.377106430529} O2 4 1 8 {} {0.311760621901 0.349981837875 0.699128119472} O3 5 1 14 {} {0.26402249389 0.505439288301 0.72640384563} Si3 6 1 14 {} {0.554688852429 0.65292223646 0.368648898628} Si4 7 1 1 {} {0.336358610329 0.101456606841 0.649094209962} H1 8 1 1 {} {0.207904844908 0.23983897902 0.490880661106} H2 9 1 1 {} {0.642689666674 0.273051255853 0.319990667741} H3 10 1 1 {} {0.6825856775 0.373265583047 0.537581197746} H4 11 1 1 {} {0.115434058306 0.51826398519 0.725077794338} H5 12 1 1 {} {0.32276399432 0.541192690862 0.856611600404} H6 13 1 1 {} {0.425055152366 0.717648223842 0.332440438839} H7 14 1 1 {} {0.656111543753 0.680016700894 0.262020506451} H8 15 1 1 {} {0.606836892077 0.710201990558 0.497283857448} H10 16 1 8 {} {0.326000351125 0.606488083272 0.608075938093} O 17 1 1 {} {0.264862963037 0.672705245068 0.574355237358} 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