#MD System 2.0 @Title neb0_image01 @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 {} {0.466944696312 0.246414252541 0.474863523782} O1 1 1 14 {} {0.327736592565 0.250112200514 0.562167884777} Si1 2 1 14 {} {0.598544448046 0.333194419869 0.429026108581} Si2 3 1 8 {} {0.55417869939 0.475945276722 0.36155422189} O2 4 1 8 {} {0.329359395311 0.379026304087 0.663370000965} O3 5 1 14 {} {0.26058704423 0.514351144724 0.727205508756} Si3 6 1 14 {} {0.533448616821 0.638853931047 0.36947386322} Si4 7 1 1 {} {0.321882367718 0.125623867679 0.643322231661} H1 8 1 1 {} {0.212342035216 0.259848992272 0.468460127565} H2 9 1 1 {} {0.669761110038 0.253561772344 0.325766727918} H3 10 1 1 {} {0.68327844789 0.360574471876 0.548585840982} H4 11 1 1 {} {0.115259748662 0.491647033367 0.748897336316} H5 12 1 1 {} {0.334954397223 0.542031532802 0.853129749555} H6 13 1 1 {} {0.392433978304 0.672718939241 0.335116356233} H7 14 1 1 {} {0.626648939756 0.705296617973 0.274284749482} H8 15 1 1 {} {0.562867686867 0.688675512361 0.508073267917} H10 16 1 8 {} {0.267779417095 0.643690851824 0.624663185484} O 17 1 1 {} {0.352078450958 0.690950829028 0.61309728131} 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 12 5 0 0 1 0 0 0 2 0 0 0 16 5 0 0 4 1 0 0 3 2 0 0 17 16 0 0 11 5 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 12 5 {0 0 0} 0 1 0 1 {0 0 0} 0 2 0 2 {0 0 0} 0 3 16 5 {0 0 0} 0 4 4 1 {0 0 0} 0 5 3 2 {0 0 0} 0 6 16 17 {0 0 0} 0 7 5 11 {0 0 0} 0 8 7 1 {0 0 0} 0 9 8 1 {0 0 0} 0 10 6 3 {0 0 0} 0 11 5 4 {0 0 0} 0 12 10 2 {0 0 0} 0 13 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