#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 {} {0.467040392449 0.232381835994 0.487549430034} O1 1 1 14 {} {0.330023975653 0.229618581691 0.577314926057} Si1 2 1 14 {} {0.583795014565 0.338554589268 0.439075829348} Si2 3 1 8 {} {0.516714199399 0.484184260925 0.403796256504} O2 4 1 8 {} {0.323085050506 0.358624226703 0.679571047391} O3 5 1 14 {} {0.279187024103 0.514955427774 0.700647098626} Si3 6 1 14 {} {0.526804834927 0.64959043527 0.401931345803} Si4 7 1 1 {} {0.329049322669 0.106531217163 0.660863617431} H1 8 1 1 {} {0.213619322375 0.234015765162 0.484858376994} H2 9 1 1 {} {0.648461911325 0.282306905471 0.316983975086} H3 10 1 1 {} {0.682063187718 0.350584255282 0.551287587675} H4 11 1 1 {} {0.131619693374 0.53106920498 0.695857919575} H5 12 1 1 {} {0.339575344564 0.560959518368 0.827644916246} H6 13 1 1 {} {0.399655209202 0.731906538549 0.392594070684} H7 14 1 1 {} {0.591545064674 0.681540484013 0.27347736276} H8 15 1 1 {} {0.605209016104 0.697645873629 0.518354285796} H10 16 1 8 {} {0.343258098144 0.604611082036 0.577474960163} O 17 1 1 {} {0.299379453518 0.683437748314 0.541774975875} 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