#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 {} {0.461322112823 0.260142771424 0.480554900587} O1 1 1 14 {} {0.327043832528 0.247884082498 0.573975562243} Si1 2 1 14 {} {0.594207436213 0.339888393345 0.426646897707} Si2 3 1 8 {} {0.552106700525 0.479121072141 0.350409952515} O2 4 1 8 {} {0.322605828924 0.367053990669 0.687225105548} O3 5 1 14 {} {0.253834005849 0.510623613458 0.731371253603} Si3 6 1 14 {} {0.541009446612 0.643158363091 0.358687526401} Si4 7 1 1 {} {0.334010100876 0.116846518775 0.644395206952} H1 8 1 1 {} {0.207058304466 0.256168930469 0.485334859692} H2 9 1 1 {} {0.660666997119 0.251995344721 0.32700360565} H3 10 1 1 {} {0.68275982835 0.372465087552 0.542497503332} H4 11 1 1 {} {0.106481132501 0.493357145711 0.74370562173} H5 12 1 1 {} {0.3193396068 0.549878575833 0.859494347183} H6 13 1 1 {} {0.409778840843 0.684509822148 0.302163564823} H7 14 1 1 {} {0.652860191527 0.704782020243 0.281473986642} H8 15 1 1 {} {0.550828123807 0.689257064429 0.501482640617} H10 16 1 8 {} {0.274905243888 0.628271388332 0.616631331247} O 17 1 1 {} {0.359268182222 0.67711343915 0.618004026731} 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