#MD System 2.0 @Title neb0_image04 @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 {} {0.467087086344 0.232570946238 0.487792957274} O1 1 1 14 {} {0.329855834269 0.229448647603 0.577369856975} Si1 2 1 14 {} {0.583667418709 0.338840644403 0.439305397936} Si2 3 1 8 {} {0.516616281746 0.484252498623 0.403666342986} O2 4 1 8 {} {0.323064830662 0.358329192992 0.67982244942} O3 5 1 14 {} {0.279239776325 0.514806936898 0.700522539054} Si3 6 1 14 {} {0.526966633688 0.649927443758 0.401852215681} Si4 7 1 1 {} {0.329084500422 0.106074990631 0.660478585418} H1 8 1 1 {} {0.213532471017 0.233939569687 0.484988717427} H2 9 1 1 {} {0.648100828524 0.28257342901 0.317179645591} H3 10 1 1 {} {0.682169996791 0.350562042614 0.551289695611} H4 11 1 1 {} {0.131454318801 0.531291492564 0.695437054055} H5 12 1 1 {} {0.3398814873 0.560942604139 0.827623934249} H6 13 1 1 {} {0.400232969725 0.73208190357 0.392752231798} H7 14 1 1 {} {0.591882573778 0.681557595293 0.273038200787} H8 15 1 1 {} {0.605109001322 0.697999254793 0.518383552213} H10 16 1 8 {} {0.343112468391 0.60454769812 0.577611335639} O 17 1 1 {} {0.299027635291 0.682771059278 0.541943268804} 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 1 0 0 0 2 0 0 0 14 6 0 0 16 5 0 2 15 6 0 0 4 1 0 0 3 2 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 0 1 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 6 {0 0 0} 0 3 16 5 {0 0 0} 0 4 15 6 {0 0 0} 0 5 4 1 {0 0 0} 0 6 3 2 {0 0 0} 0 7 7 1 {0 0 0} 0 8 8 1 {0 0 0} 0 9 6 3 {0 0 0} 0 10 5 4 {0 0 0} 0 11 10 2 {0 0 0} 0 12 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