#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 {} {0.463763061513 0.247773722647 0.489234745337} O1 1 1 14 {} {0.327160909155 0.234859672218 0.579021246841} Si1 2 1 14 {} {0.584656712439 0.343987406718 0.432028767154} Si2 3 1 8 {} {0.525374950954 0.487882618965 0.381924741245} O2 4 1 8 {} {0.315696984105 0.354603831765 0.690829906768} O3 5 1 14 {} {0.267294469405 0.50891015092 0.71971980831} Si3 6 1 14 {} {0.546420072412 0.6508342665 0.374975768815} Si4 7 1 1 {} {0.333211206785 0.105462757334 0.652365016651} H1 8 1 1 {} {0.208861329804 0.239758102405 0.48842061426} H2 9 1 1 {} {0.646563149694 0.271259037544 0.317538542034} H3 10 1 1 {} {0.682087251636 0.368764890031 0.541875860271} H4 11 1 1 {} {0.118335141583 0.516856264517 0.724173728036} H5 12 1 1 {} {0.327073146934 0.548123675816 0.849977230679} H6 13 1 1 {} {0.416116316537 0.71300054388 0.342177931118} H7 14 1 1 {} {0.643552083226 0.679400913129 0.265816914416} H8 15 1 1 {} {0.601338404506 0.706140036144 0.500811743017} H10 16 1 8 {} {0.325091682562 0.605446193164 0.597430754573} O 17 1 1 {} {0.277489291137 0.689453934351 0.58273455718} 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