#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 {} {0.472968952877 0.240075289625 0.487579989033} O1 1 1 14 {} {0.326984645971 0.22647486281 0.563587374685} Si1 2 1 14 {} {0.600575569072 0.342644635158 0.466036614697} Si2 3 1 8 {} {0.552296569248 0.497105880761 0.492492489472} O2 4 1 8 {} {0.285915339363 0.363229872478 0.642703643711} O3 5 1 14 {} {0.248590249398 0.52144689871 0.665044687294} Si3 6 1 14 {} {0.558747868686 0.652366804175 0.44025319075} Si4 7 1 1 {} {0.339157659615 0.115334701572 0.662641574321} H1 8 1 1 {} {0.224635193542 0.197207640917 0.459880717083} H2 9 1 1 {} {0.645295733184 0.33246246593 0.324251357973} H3 10 1 1 {} {0.708792376447 0.311260307218 0.564461430698} H4 11 1 1 {} {0.134089147218 0.522061815865 0.758847398814} H5 12 1 1 {} {0.368956590571 0.595730572231 0.714918318485} H6 13 1 1 {} {0.466613941997 0.728027248394 0.530582528972} H7 14 1 1 {} {0.514601004313 0.667582009913 0.297480966657} H8 15 1 1 {} {0.698799584414 0.704943327936 0.449209288133} H10 16 1 8 {} {0.200152017499 0.593953898476 0.522608248512} O 17 1 1 {} {0.262913570514 0.6606097347 0.488478332183} 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