#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 {} {0.467587234476 0.241225471621 0.472354935971} O1 1 1 14 {} {0.328372798209 0.249197503878 0.558879338656} Si1 2 1 14 {} {0.598190901049 0.331359143912 0.431184541577} Si2 3 1 8 {} {0.551051369848 0.475744147087 0.368741024712} O2 4 1 8 {} {0.334004071574 0.379841102101 0.658381575245} O3 5 1 14 {} {0.266503956366 0.51471565313 0.723000417723} Si3 6 1 14 {} {0.530304353959 0.638606972925 0.373561296003} Si4 7 1 1 {} {0.318846742896 0.125268084166 0.639933130274} H1 8 1 1 {} {0.214292123115 0.260250871997 0.464528426121} H2 9 1 1 {} {0.671872763939 0.254510617066 0.327987363172} H3 10 1 1 {} {0.683536476206 0.352874460553 0.551334454111} H4 11 1 1 {} {0.121822330075 0.492369831806 0.74538741355} H5 12 1 1 {} {0.341300559587 0.540462573562 0.849290999328} H6 13 1 1 {} {0.387967863459 0.672496406803 0.345543683593} H7 14 1 1 {} {0.61717575096 0.704263349399 0.270982341343} H8 15 1 1 {} {0.562856625922 0.689324388027 0.511139894305} H10 16 1 8 {} {0.269887903188 0.643970421425 0.620425185349} O 17 1 1 {} {0.344512316188 0.706036947186 0.618401964335} 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