#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 {} {0.457976585092 0.264666473003 0.492382337242} O1 1 1 14 {} {0.32427132297 0.236869199855 0.582152471944} Si1 2 1 14 {} {0.582769291529 0.351092086465 0.430833009584} Si2 3 1 8 {} {0.530918441633 0.494477082417 0.370189549262} O2 4 1 8 {} {0.306352388104 0.350315408705 0.700501446245} O3 5 1 14 {} {0.259631465058 0.504108102251 0.734444106968} Si3 6 1 14 {} {0.562534093801 0.65627963466 0.362055471136} Si4 7 1 1 {} {0.339743946323 0.105225267427 0.649198491527} H1 8 1 1 {} {0.206170215384 0.2395863068 0.491155447866} H2 9 1 1 {} {0.640327817012 0.27040080086 0.320036860281} H3 10 1 1 {} {0.683201930987 0.375707815903 0.538082732842} H4 11 1 1 {} {0.109747671235 0.512761032454 0.733498538939} H5 12 1 1 {} {0.317454271288 0.536398439925 0.867650107601} H6 13 1 1 {} {0.435432583219 0.725572470968 0.325100929048} H7 14 1 1 {} {0.663699477855 0.682046155863 0.255638775845} H8 15 1 1 {} {0.611097642106 0.708505096438 0.493296251164} H10 16 1 8 {} {0.320083753335 0.612993412305 0.625617997082} O 17 1 1 {} {0.258673310885 0.645513273947 0.559223223353} 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