#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 {} {0.471378115577 0.22571383567 0.489992303601} O1 1 1 14 {} {0.332208028294 0.223168688172 0.575248846963} Si1 2 1 14 {} {0.590287098644 0.333185202544 0.446063797658} Si2 3 1 8 {} {0.531675348357 0.482300797078 0.419998356049} O2 4 1 8 {} {0.326287320366 0.356875383201 0.674491734865} O3 5 1 14 {} {0.287578182671 0.51434604948 0.681998220858} Si3 6 1 14 {} {0.500827957267 0.648606959363 0.428268451958} Si4 7 1 1 {} {0.326377897168 0.100752173009 0.660362484661} H1 8 1 1 {} {0.214979252591 0.230998887932 0.483983900835} H2 9 1 1 {} {0.649740935325 0.27954984746 0.321070242477} H3 10 1 1 {} {0.688670205377 0.330930584665 0.558083140449} H4 11 1 1 {} {0.142003279827 0.540178670345 0.673701849418} H5 12 1 1 {} {0.357825974612 0.574560223597 0.797435503231} H6 13 1 1 {} {0.404377892645 0.774530859084 0.435308586098} H7 14 1 1 {} {0.530871923039 0.674643058536 0.284549884981} H8 15 1 1 {} {0.599560192515 0.696514842931 0.528903225899} H10 16 1 8 {} {0.340778993345 0.595551994672 0.543390751064} O 17 1 1 {} {0.31465750152 0.690109876362 0.528206713744} 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