#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 {} {0.469804267545 0.226674212342 0.483550640855} O1 1 1 14 {} {0.332635147007 0.23561029695 0.573799971969} Si1 2 1 14 {} {0.592854716389 0.325364161922 0.439435518655} Si2 3 1 8 {} {0.533188364064 0.47668480602 0.403456907869} O2 4 1 8 {} {0.333775950052 0.372181045674 0.657229995976} O3 5 1 14 {} {0.282555552479 0.523159357735 0.692475065371} Si3 6 1 14 {} {0.503190981814 0.640457933779 0.424302405561} Si4 7 1 1 {} {0.330817981346 0.116225641725 0.662630699644} H1 8 1 1 {} {0.21618202514 0.232489278493 0.482209968266} H2 9 1 1 {} {0.661141651456 0.25028285353 0.328549490715} H3 10 1 1 {} {0.691467651297 0.3314046368 0.55092701109} H4 11 1 1 {} {0.136694800828 0.5254877413 0.698762892957} H5 12 1 1 {} {0.340124902547 0.562941729092 0.820015878474} H6 13 1 1 {} {0.376691408369 0.767227816612 0.425847047284} H7 14 1 1 {} {0.53973789516 0.68468048358 0.284190381597} H8 15 1 1 {} {0.592956419703 0.682805999736 0.534132374388} H10 16 1 8 {} {0.345940374764 0.616126217887 0.568979561656} O 17 1 1 {} {0.330326037772 0.702713745861 0.500562166724} 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