#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 {} {0.467703323184 0.243657285427 0.471373746786} O1 1 1 14 {} {0.327326854334 0.25045262884 0.556427034556} Si1 2 1 14 {} {0.602276827416 0.32966408409 0.431723151384} Si2 3 1 8 {} {0.560557044346 0.475828764203 0.365641579638} O2 4 1 8 {} {0.331641851587 0.379279937139 0.658598173547} O3 5 1 14 {} {0.266944870626 0.5119775679 0.728580022769} Si3 6 1 14 {} {0.526052555414 0.636775534097 0.370811134874} Si4 7 1 1 {} {0.316641450879 0.126579620188 0.63801564083} H1 8 1 1 {} {0.213685857703 0.2644113772 0.4612068637} H2 9 1 1 {} {0.675319375224 0.248812091697 0.329944902539} H3 10 1 1 {} {0.68497998515 0.350258644473 0.554553536589} H4 11 1 1 {} {0.121276842156 0.488059810284 0.748013518201} H5 12 1 1 {} {0.341822336837 0.531286200917 0.85623181541} H6 13 1 1 {} {0.387825819762 0.684205516554 0.335837258573} H7 14 1 1 {} {0.613041337043 0.704377086059 0.271816365093} H8 15 1 1 {} {0.559151200369 0.689323436693 0.507124329757} H10 16 1 8 {} {0.272970433484 0.646211141662 0.629542395764} O 17 1 1 {} {0.340868168787 0.711357224126 0.615616523898} 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