#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 {} {0.465337387614 0.256032463729 0.488273356361} O1 1 1 14 {} {0.325934528297 0.229563083551 0.570008933969} Si1 2 1 14 {} {0.593735329117 0.347723653249 0.444726806714} Si2 3 1 8 {} {0.548074171556 0.502107440591 0.419998252537} O2 4 1 8 {} {0.291788967315 0.349424612652 0.676186000203} O3 5 1 14 {} {0.250202699717 0.50556940292 0.703848354966} Si3 6 1 14 {} {0.568047453726 0.663952361566 0.400122888369} Si4 7 1 1 {} {0.341412881058 0.10421030098 0.648966736363} H1 8 1 1 {} {0.216188834061 0.217198452094 0.46955312648} H2 9 1 1 {} {0.647513095682 0.289664254959 0.319575796867} H3 10 1 1 {} {0.695838557803 0.344773460455 0.552472019744} H4 11 1 1 {} {0.107475401967 0.515931578225 0.747623180024} H5 12 1 1 {} {0.343114110508 0.557513382343 0.807778804802} H6 13 1 1 {} {0.439620468847 0.733028757447 0.424685221606} H7 14 1 1 {} {0.611101897739 0.691262521064 0.259902840679} H8 15 1 1 {} {0.673768733209 0.71297041143 0.493642946733} H10 16 1 8 {} {0.27123387362 0.58590093422 0.560603930195} O 17 1 1 {} {0.219697616503 0.665690788491 0.543088951426} 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