#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 {} {0.471339532761 0.229824561809 0.484629510564} O1 1 1 14 {} {0.3310417536 0.224555161999 0.568861756026} Si1 2 1 14 {} {0.59511858437 0.335053447349 0.452967121018} Si2 3 1 8 {} {0.536957694099 0.487358679668 0.4524742852} O2 4 1 8 {} {0.313906232235 0.360843153627 0.658511972829} O3 5 1 14 {} {0.274261525191 0.517936812888 0.67476468292} Si3 6 1 14 {} {0.523071823368 0.653026844217 0.431008417753} Si4 7 1 1 {} {0.331621426477 0.108629787562 0.661519747211} H1 8 1 1 {} {0.218899154273 0.215183845082 0.472243461338} H2 9 1 1 {} {0.651053376468 0.289558071759 0.321619152973} H3 10 1 1 {} {0.699415851752 0.325268894175 0.558097068526} H4 11 1 1 {} {0.129592995715 0.531038762534 0.712433811118} H5 12 1 1 {} {0.368269093295 0.584862694025 0.771098631305} H6 13 1 1 {} {0.431962183427 0.771448946376 0.471396837527} H7 14 1 1 {} {0.518672690322 0.665102651119 0.283081423593} H8 15 1 1 {} {0.642012397869 0.700696691297 0.510903490147} H10 16 1 8 {} {0.29194916616 0.587526632146 0.524689159383} O 17 1 1 {} {0.280940559297 0.684602274061 0.520757516866} 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