#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 {} {0.470803127261 0.261461857115 0.489855561264} O1 1 1 14 {} {0.324592676552 0.230849791752 0.558231124488} Si1 2 1 14 {} {0.60925725041 0.346241204994 0.472384349294} Si2 3 1 8 {} {0.589350055295 0.502823381742 0.519544158558} O2 4 1 8 {} {0.258146100042 0.365473086295 0.622427635311} O3 5 1 14 {} {0.235597727841 0.524932447785 0.657267034396} Si3 6 1 14 {} {0.577180775437 0.654647396884 0.456757042082} Si4 7 1 1 {} {0.340104202627 0.131040723128 0.668925776133} H1 8 1 1 {} {0.237839336622 0.181135737834 0.447611426747} H2 9 1 1 {} {0.647504741147 0.341961488153 0.328745025384} H3 10 1 1 {} {0.715093967709 0.28689337014 0.557558745488} H4 11 1 1 {} {0.135699595006 0.535457388218 0.766374548943} H5 12 1 1 {} {0.365051943795 0.587836201267 0.698875421584} H6 13 1 1 {} {0.522634115979 0.75025310929 0.558583955373} H7 14 1 1 {} {0.479852717201 0.651130171641 0.343155036516} H8 15 1 1 {} {0.709248709717 0.707325970462 0.412690363868} H10 16 1 8 {} {0.170307601414 0.602105108718 0.526939938986} O 17 1 1 {} {0.221821400872 0.610949667323 0.445131047123} 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