#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 {} {0.46785529953 0.241231165074 0.472992378379} O1 1 1 14 {} {0.328353766257 0.249064332142 0.559616086261} Si1 2 1 14 {} {0.598401425228 0.331604282892 0.430269681107} Si2 3 1 8 {} {0.551516103489 0.475385945294 0.367387430883} O2 4 1 8 {} {0.331492399369 0.379726478773 0.659012317601} O3 5 1 14 {} {0.263685500309 0.515218643498 0.722680387548} Si3 6 1 14 {} {0.530521511878 0.638200128037 0.373863512976} Si4 7 1 1 {} {0.319604158458 0.125994076185 0.64253843183} H1 8 1 1 {} {0.21330728667 0.259842585352 0.465753656193} H2 9 1 1 {} {0.671326014124 0.256719652722 0.324679953566} H3 10 1 1 {} {0.682343713417 0.356311958643 0.551006322268} H4 11 1 1 {} {0.119710075204 0.489293111043 0.746737036912} H5 12 1 1 {} {0.3399692516 0.546693757955 0.846628537319} H6 13 1 1 {} {0.388016322115 0.670082880354 0.344726884631} H7 14 1 1 {} {0.619838996635 0.702983050071 0.273848487412} H8 15 1 1 {} {0.565966883505 0.690557288349 0.509994283787} H10 16 1 8 {} {0.269294748793 0.644883624802 0.619421135674} O 17 1 1 {} {0.348882687152 0.698724976715 0.619901473767} 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