#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 {} {0.464696654981 0.254459298644 0.477073418375} O1 1 1 14 {} {0.327274211519 0.251302786753 0.566636684073} Si1 2 1 14 {} {0.598040048873 0.336074360906 0.426956505458} Si2 3 1 8 {} {0.556718449131 0.476658291347 0.352726393139} O2 4 1 8 {} {0.325323125413 0.376432234664 0.672275819107} O3 5 1 14 {} {0.255941734877 0.513358013012 0.733037291721} Si3 6 1 14 {} {0.537685738821 0.639928663018 0.362534954904} Si4 7 1 1 {} {0.326730182943 0.124250139025 0.644234112703} H1 8 1 1 {} {0.210314703767 0.25961903881 0.474190762179} H2 9 1 1 {} {0.666924357311 0.250258427651 0.327216117902} H3 10 1 1 {} {0.684189426118 0.3670183176 0.544829956227} H4 11 1 1 {} {0.109611649319 0.493983282029 0.751044028393} H5 12 1 1 {} {0.326742670898 0.540682453851 0.861177688385} H6 13 1 1 {} {0.400061705726 0.677201970814 0.318908871966} H7 14 1 1 {} {0.63874385511 0.707288623206 0.276238961575} H8 15 1 1 {} {0.557181920662 0.685352168076 0.504427273865} H10 16 1 8 {} {0.268122545156 0.640734800084 0.628440507694} O 17 1 1 {} {0.355782949954 0.677914977407 0.609108554147} 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