#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 {} {0.467139135933 0.232866617707 0.488132314034} O1 1 1 14 {} {0.329675491563 0.229193774045 0.57742322553} Si1 2 1 14 {} {0.583549007888 0.339112105878 0.439603551783} Si2 3 1 8 {} {0.516556820849 0.484484057704 0.403466940588} O2 4 1 8 {} {0.323008674124 0.35790867109 0.680162100436} O3 5 1 14 {} {0.279284410634 0.51458439063 0.700479612283} Si3 6 1 14 {} {0.527123405222 0.650237371156 0.401751789744} Si4 7 1 1 {} {0.329103963921 0.105459114178 0.659962225011} H1 8 1 1 {} {0.213437088778 0.233869640148 0.48516467397} H2 9 1 1 {} {0.647665083114 0.282876309832 0.317441825497} H3 10 1 1 {} {0.682283208241 0.350512490101 0.551290926242} H4 11 1 1 {} {0.131275885755 0.531518774784 0.694920462619} H5 12 1 1 {} {0.340257579321 0.560859103828 0.827587447902} H6 13 1 1 {} {0.400903587659 0.732423059148 0.392867514365} H7 14 1 1 {} {0.59235181709 0.681610068422 0.272474907709} H8 15 1 1 {} {0.604972045357 0.698431148633 0.518403403393} H10 16 1 8 {} {0.342979195685 0.60437183759 0.577813082869} O 17 1 1 {} {0.298519708975 0.68219941437 0.542111975904} 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