#MD System 2.0 @Title neb0_image03 @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 {} {0.468241024699 0.230622051316 0.479802760562} O1 1 1 14 {} {0.330363837812 0.239395241205 0.56858328525} Si1 2 1 14 {} {0.590909069108 0.330925974974 0.434845077019} Si2 3 1 8 {} {0.531309917626 0.475514161889 0.3860284636} O2 4 1 8 {} {0.332595353331 0.373558213257 0.661998049433} O3 5 1 14 {} {0.272795951004 0.519346580091 0.707802468208} Si3 6 1 14 {} {0.526660743314 0.640934487108 0.390256903012} Si4 7 1 1 {} {0.32840146197 0.121208784727 0.658450601033} H1 8 1 1 {} {0.213354019998 0.240318088455 0.476418439887} H2 9 1 1 {} {0.659820677444 0.262906295578 0.32180784237} H3 10 1 1 {} {0.685764869741 0.348532615102 0.549665281619} H4 11 1 1 {} {0.12490893805 0.51500217413 0.719729753098} H5 12 1 1 {} {0.339162560515 0.559857910065 0.8336127564} H6 13 1 1 {} {0.389289630057 0.694070423935 0.377356446249} H7 14 1 1 {} {0.602279322769 0.692516092655 0.271489764742} H8 15 1 1 {} {0.587191545778 0.689504317663 0.518527193592} H10 16 1 8 {} {0.314937143278 0.622041627903 0.583525322403} O 17 1 1 {} {0.31210004583 0.716262927088 0.591157578817} 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