#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 {} {0.469778613764 0.226777385573 0.483566453494} O1 1 1 14 {} {0.332682347681 0.23489285643 0.573266391455} Si1 2 1 14 {} {0.592482119431 0.325666260751 0.439629312772} Si2 3 1 8 {} {0.532503126504 0.476753322403 0.404085057007} O2 4 1 8 {} {0.333974293969 0.371775636367 0.657434548579} O3 5 1 14 {} {0.282832056558 0.522395938135 0.692534678885} Si3 6 1 14 {} {0.502761325145 0.640350377526 0.425097650513} Si4 7 1 1 {} {0.330827287049 0.116619334894 0.66265772461} H1 8 1 1 {} {0.216114018544 0.232539810306 0.482290917247} H2 9 1 1 {} {0.660614431552 0.251424381232 0.328532536077} H3 10 1 1 {} {0.691212421403 0.331883081057 0.550777788709} H4 11 1 1 {} {0.136223768423 0.526234121727 0.698251923797} H5 12 1 1 {} {0.34043344517 0.56359346021 0.820254612234} H6 13 1 1 {} {0.378249979702 0.766391334495 0.425797598496} H7 14 1 1 {} {0.53912909206 0.684740998613 0.284400723655} H8 15 1 1 {} {0.593264230373 0.683485325458 0.534184301699} H10 16 1 8 {} {0.346698632273 0.61523893916 0.568060646125} O 17 1 1 {} {0.330304937531 0.70175539488 0.500235113156} 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