#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 {} {0.463241826493 0.257737716756 0.478416271544} O1 1 1 14 {} {0.327082842482 0.250429660607 0.569660939832} Si1 2 1 14 {} {0.596597127934 0.337534702349 0.426227154802} Si2 3 1 8 {} {0.555951484364 0.477295017042 0.350026531549} O2 4 1 8 {} {0.322748891839 0.372913038672 0.67869991166} O3 5 1 14 {} {0.254265421178 0.512572373987 0.733477705733} Si3 6 1 14 {} {0.539589365163 0.640786095946 0.359861275253} Si4 7 1 1 {} {0.329898317067 0.121845290179 0.644404659983} H1 8 1 1 {} {0.209649418395 0.259461090308 0.478330284218} H2 9 1 1 {} {0.665014563675 0.250403896117 0.327494391217} H3 10 1 1 {} {0.683606382177 0.369663161133 0.542991451886} H4 11 1 1 {} {0.107669420767 0.494037802349 0.749963904649} H5 12 1 1 {} {0.323082270596 0.543249698224 0.861884558723} H6 13 1 1 {} {0.404712730601 0.679288720112 0.310885830935} H7 14 1 1 {} {0.645282659017 0.707202233601 0.278029557394} H8 15 1 1 {} {0.553825622442 0.685439657232 0.502716736515} H10 16 1 8 {} {0.269834923413 0.636912279117 0.625855721884} O 17 1 1 {} {0.358032637533 0.675745347872 0.612130988356} 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