#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 {} {0.465744971063 0.261574769375 0.491408064427} O1 1 1 14 {} {0.325150803886 0.229416061731 0.568503832635} Si1 2 1 14 {} {0.597455171916 0.348310009849 0.447284132472} Si2 3 1 8 {} {0.555079048664 0.505253049876 0.426969295302} O2 4 1 8 {} {0.285137883226 0.347534648011 0.675035365982} O3 5 1 14 {} {0.242831643345 0.503588513209 0.700322383071} Si3 6 1 14 {} {0.580082865098 0.665969001466 0.400643363907} Si4 7 1 1 {} {0.343531417428 0.105339503282 0.646990005434} H1 8 1 1 {} {0.217618117567 0.214499195554 0.466421415032} H2 9 1 1 {} {0.648038028268 0.290559217516 0.318222427574} H3 10 1 1 {} {0.701198568974 0.340634559753 0.555908787442} H4 11 1 1 {} {0.106471575301 0.50975370045 0.761018548371} H5 12 1 1 {} {0.343395440699 0.561509347228 0.793474571016} H6 13 1 1 {} {0.454872605817 0.73796100502 0.436054222972} H7 14 1 1 {} {0.614159587121 0.68967585534 0.257164272292} H8 15 1 1 {} {0.69308560777 0.716145878688 0.484333728249} H10 16 1 8 {} {0.241539019255 0.579990843032 0.553511122052} O 17 1 1 {} {0.194693603539 0.664802663689 0.547792706394} 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