#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 {} {0.467205482741 0.244407773162 0.473735789868} O1 1 1 14 {} {0.328117966519 0.249878410319 0.561014322686} Si1 2 1 14 {} {0.598618275388 0.332706836848 0.429854238699} Si2 3 1 8 {} {0.553424192334 0.475821511787 0.363743796189} O2 4 1 8 {} {0.330405000691 0.379603044361 0.661531356394} O3 5 1 14 {} {0.262221638013 0.515023019135 0.725677430015} Si3 6 1 14 {} {0.532280034992 0.638847357492 0.370809304703} Si4 7 1 1 {} {0.320722194486 0.125968259664 0.642978512519} H1 8 1 1 {} {0.213164018031 0.259362495005 0.466770621157} H2 9 1 1 {} {0.670212051714 0.254077429593 0.326420737061} H3 10 1 1 {} {0.683761853962 0.35788250122 0.549702827549} H4 11 1 1 {} {0.117612404345 0.491387515871 0.748059946472} H5 12 1 1 {} {0.336481328541 0.543252371419 0.851736012604} H6 13 1 1 {} {0.39086102629 0.673348028666 0.338705261948} H7 14 1 1 {} {0.623347065781 0.704883107226 0.273154351491} H8 15 1 1 {} {0.563351199516 0.68865874266 0.508924665778} H10 16 1 8 {} {0.267284486097 0.643624219548 0.622795525359} O 17 1 1 {} {0.351015894434 0.693785341388 0.615443288967} 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