#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 {} {0.467589078915 0.241253345349 0.472351171985} O1 1 1 14 {} {0.328388659599 0.24922078076 0.558874869699} Si1 2 1 14 {} {0.598210588349 0.33135473452 0.431186482939} Si2 3 1 8 {} {0.5510624595 0.475742388038 0.368741925895} O2 4 1 8 {} {0.334003911727 0.379794462353 0.658371047353} O3 5 1 14 {} {0.26654556924 0.514736593993 0.723066871834} Si3 6 1 14 {} {0.530220494251 0.638646912596 0.373512298459} Si4 7 1 1 {} {0.31882504175 0.125262245501 0.639899105237} H1 8 1 1 {} {0.214308403511 0.260260055279 0.464504444226} H2 9 1 1 {} {0.671902978285 0.254428458405 0.328062529089} H3 10 1 1 {} {0.683559483575 0.352786976091 0.551344762532} H4 11 1 1 {} {0.121880571424 0.492377847156 0.745375560648} H5 12 1 1 {} {0.341294094921 0.540325512251 0.849374401428} H6 13 1 1 {} {0.388022901699 0.672587763296 0.345526142118} H7 14 1 1 {} {0.617155145009 0.704312065194 0.270889027382} H8 15 1 1 {} {0.562782324238 0.689291891131 0.511184808482} H10 16 1 8 {} {0.269968345216 0.644096125191 0.620410135681} O 17 1 1 {} {0.344366089602 0.706039789459 0.618382400256} 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