#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 {} {0.467012913126 0.245235540268 0.471429162998} O1 1 1 14 {} {0.327348072269 0.252292891257 0.556072646969} Si1 2 1 14 {} {0.603034461635 0.328915253561 0.431840300175} Si2 3 1 8 {} {0.565110321626 0.473485766955 0.365022298073} O2 4 1 8 {} {0.331025673506 0.378769444367 0.656967382138} O3 5 1 14 {} {0.265585526803 0.510912038849 0.730958259884} Si3 6 1 14 {} {0.526538197161 0.635162784745 0.370132206946} Si4 7 1 1 {} {0.315983421591 0.12801862515 0.636833633535} H1 8 1 1 {} {0.213836207421 0.266259642805 0.460477222449} H2 9 1 1 {} {0.675802073819 0.249253211593 0.330239570079} H3 10 1 1 {} {0.684408909444 0.351213333791 0.554469577176} H4 11 1 1 {} {0.120892489962 0.486417879263 0.749758280106} H5 12 1 1 {} {0.341171011318 0.529795639171 0.855759663099} H6 13 1 1 {} {0.386374665875 0.686377287604 0.331401639642} H7 14 1 1 {} {0.612422276119 0.704022018518 0.273448157629} H8 15 1 1 {} {0.558666415611 0.690509385697 0.504771721253} H10 16 1 8 {} {0.275556477965 0.645729527922 0.634927183836} O 17 1 1 {} {0.339317026927 0.7101476905 0.616549094013} 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