#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 {} {0.467020221857 0.246110495664 0.474705660001} O1 1 1 14 {} {0.327801485592 0.250056331507 0.56194749089} Si1 2 1 14 {} {0.598572519603 0.333064423722 0.429154056184} Si2 3 1 8 {} {0.554091418323 0.475942353032 0.361964790088} O2 4 1 8 {} {0.329553371532 0.37908002156 0.66300798708} O3 5 1 14 {} {0.260874383326 0.51432253869 0.726982507355} Si3 6 1 14 {} {0.533209268258 0.638814256113 0.369729821502} Si4 7 1 1 {} {0.321674889651 0.125717944923 0.643243453519} H1 8 1 1 {} {0.21246872991 0.259807196179 0.468207996825} H2 9 1 1 {} {0.669847410918 0.253630973585 0.32582111494} H3 10 1 1 {} {0.683311091085 0.360168983824 0.54879645393} H4 11 1 1 {} {0.11563139206 0.491640072487 0.748752938768} H5 12 1 1 {} {0.335241269266 0.542177890887 0.852887292338} H6 13 1 1 {} {0.392141602195 0.67280404746 0.335712726123} H7 14 1 1 {} {0.626040678652 0.705191436883 0.274176780227} H8 15 1 1 {} {0.562998766756 0.688699559903 0.508187445893} H10 16 1 8 {} {0.267857673175 0.643800329853 0.624348612413} O 17 1 1 {} {0.351749906205 0.691489097888 0.613430840663} 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