#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 {} {0.459476510176 0.262647886627 0.493473464468} O1 1 1 14 {} {0.324858823511 0.236447943697 0.582007837743} Si1 2 1 14 {} {0.583237491934 0.349741002315 0.431562131316} Si2 3 1 8 {} {0.530040354211 0.493445869059 0.372077370763} O2 4 1 8 {} {0.307268916216 0.350157107155 0.699804905663} O3 5 1 14 {} {0.261431639075 0.503663861735 0.732622840091} Si3 6 1 14 {} {0.559066518871 0.655632853738 0.363545892164} Si4 7 1 1 {} {0.338730953038 0.104641471156 0.648563932628} H1 8 1 1 {} {0.206041858013 0.239564252658 0.492238424724} H2 9 1 1 {} {0.639872473958 0.270475063236 0.319233407677} H3 10 1 1 {} {0.683532880615 0.375321268665 0.539284816941} H4 11 1 1 {} {0.112886911416 0.514767473699 0.729846438164} H5 12 1 1 {} {0.318398425471 0.536487872077 0.865043492425} H6 13 1 1 {} {0.432771794427 0.725754494223 0.325799971159} H7 14 1 1 {} {0.661541245333 0.681326236166 0.257183034306} H8 15 1 1 {} {0.608599126171 0.707875244872 0.494417682917} H10 16 1 8 {} {0.323587201377 0.61037930652 0.620889543073} O 17 1 1 {} {0.258743083204 0.654188847734 0.563462605448} 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