#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 {} {0.456512513356 0.267625968722 0.49024761418} O1 1 1 14 {} {0.323780832994 0.238417524533 0.582189158174} Si1 2 1 14 {} {0.5827116528 0.35145465913 0.429683984858} Si2 3 1 8 {} {0.533733664506 0.495006685068 0.368232575391} O2 4 1 8 {} {0.304473595192 0.350789319545 0.70010698133} O3 5 1 14 {} {0.256180766262 0.503681185753 0.73885536349} Si3 6 1 14 {} {0.564868638061 0.656600547729 0.361384536445} Si4 7 1 1 {} {0.340877866047 0.106401780847 0.649228365893} H1 8 1 1 {} {0.206289383948 0.239934578964 0.489903839624} H2 9 1 1 {} {0.641570249019 0.27007319059 0.320994011627} H3 10 1 1 {} {0.682704403419 0.376457728408 0.536872220699} H4 11 1 1 {} {0.107457643782 0.509699256962 0.737792894928} H5 12 1 1 {} {0.316520644914 0.536048969378 0.869763740162} H6 13 1 1 {} {0.437216730522 0.724385902469 0.325802844508} H7 14 1 1 {} {0.665673158835 0.683932335989 0.255155861388} H8 15 1 1 {} {0.615587334213 0.708655155007 0.490935375961} H10 16 1 8 {} {0.315461056364 0.618333412947 0.631892089449} O 17 1 1 {} {0.25846606378 0.635019860324 0.55201621995} 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