#MD System 2.0 @Title neb0_image03 @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 {} {0.459488204094 0.258664095272 0.479536642398} O1 1 1 14 {} {0.326152704512 0.240989521828 0.572843459904} Si1 2 1 14 {} {0.592096658499 0.343135511218 0.431990253584} Si2 3 1 8 {} {0.54778785152 0.490859890002 0.376786080531} O2 4 1 8 {} {0.307291836667 0.366493393765 0.676740987134} O3 5 1 14 {} {0.251509805863 0.513610373123 0.727539585571} Si3 6 1 14 {} {0.563255588883 0.654463519759 0.376900442488} Si4 7 1 1 {} {0.340643384458 0.116060447908 0.653112995196} H1 8 1 1 {} {0.208548797342 0.233419358594 0.480034120346} H2 9 1 1 {} {0.655696778852 0.266788260653 0.321856511559} H3 10 1 1 {} {0.684732500202 0.35740719076 0.548009369732} H4 11 1 1 {} {0.104090326255 0.499634299219 0.749811143943} H5 12 1 1 {} {0.323009745981 0.550692048582 0.852608466066} H6 13 1 1 {} {0.426396976825 0.715767589481 0.378971581283} H7 14 1 1 {} {0.632307670434 0.698497313814 0.253099298962} H8 15 1 1 {} {0.638053864791 0.698037223767 0.497976223686} H10 16 1 8 {} {0.287647678338 0.635194793147 0.62293066896} O 17 1 1 {} {0.26137565783 0.632803137082 0.530309773347} 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