#MD System 2.0 @Title neb0_image04 @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 {} {0.464320192055 0.247314470307 0.486435786297} O1 1 1 14 {} {0.325277217006 0.230773519909 0.572947031763} Si1 2 1 14 {} {0.58891493595 0.345292982141 0.44306505562} Si2 3 1 8 {} {0.535451964187 0.496330275959 0.412232280272} O2 4 1 8 {} {0.302539054394 0.354339305081 0.677395864485} O3 5 1 14 {} {0.258313703615 0.50916391325 0.70681121126} Si3 6 1 14 {} {0.554353029959 0.660027524642 0.399224283732} Si4 7 1 1 {} {0.337220452629 0.105161952651 0.65209779906} H1 8 1 1 {} {0.215864000295 0.219980436184 0.472932171675} H2 9 1 1 {} {0.647951959251 0.289702141419 0.319126036956} H3 10 1 1 {} {0.69175771337 0.345835088437 0.550679332459} H4 11 1 1 {} {0.111584056263 0.520267964191 0.732741682257} H5 12 1 1 {} {0.342752015163 0.554171428077 0.819699283068} H6 13 1 1 {} {0.423066841765 0.733977783076 0.415827495371} H7 14 1 1 {} {0.606670780457 0.691340751066 0.261795663201} H8 15 1 1 {} {0.648836621634 0.711423621702 0.504810420803} H10 16 1 8 {} {0.301147767011 0.591714854093 0.571341868408} O 17 1 1 {} {0.254063744432 0.665699845653 0.531894788249} 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