#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 {} {0.459549214674 0.258555390009 0.493345425621} O1 1 1 14 {} {0.324652037903 0.23447589499 0.583063201974} Si1 2 1 14 {} {0.581374693292 0.348878506996 0.432708230868} Si2 3 1 8 {} {0.526261207059 0.491837079587 0.374654226376} O2 4 1 8 {} {0.30966426972 0.350052906514 0.699333077893} O3 5 1 14 {} {0.263174818056 0.504347299972 0.72936938955} Si3 6 1 14 {} {0.556618224267 0.654546071062 0.366090154475} Si4 7 1 1 {} {0.337640098032 0.101871784905 0.648296992991} H1 8 1 1 {} {0.207904551159 0.239685115331 0.492087025518} H2 9 1 1 {} {0.640927885638 0.273406708992 0.319217344399} H3 10 1 1 {} {0.683901684388 0.374352018394 0.538531651732} H4 11 1 1 {} {0.114330881338 0.517545523623 0.725625615019} H5 12 1 1 {} {0.321537649361 0.539233289686 0.861414106936} H6 13 1 1 {} {0.428011445904 0.721513177954 0.328849844242} H7 14 1 1 {} {0.660110826718 0.680496914137 0.259857032212} H8 15 1 1 {} {0.608074743284 0.70944528344 0.495756774467} H10 16 1 8 {} {0.324630152124 0.607252103369 0.612888559193} O 17 1 1 {} {0.261721811486 0.665022981007 0.569969149404} 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