#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 {} {0.464830168749 0.253503560005 0.47680411143} O1 1 1 14 {} {0.327432903477 0.251283449958 0.566206176623} Si1 2 1 14 {} {0.597963850902 0.335799294581 0.427175674297} Si2 3 1 8 {} {0.556506005661 0.476477551484 0.353531348903} O2 4 1 8 {} {0.325262128632 0.376925945344 0.670889704148} O3 5 1 14 {} {0.256526866296 0.513807051278 0.732483799714} Si3 6 1 14 {} {0.537396962609 0.639698256779 0.363177537981} Si4 7 1 1 {} {0.326074505355 0.124515232244 0.644093003034} H1 8 1 1 {} {0.210757087796 0.259745071428 0.473739936339} H2 9 1 1 {} {0.667144413337 0.251039748398 0.32717517232} H3 10 1 1 {} {0.684173265919 0.366544843531 0.544867879757} H4 11 1 1 {} {0.11074438046 0.493674104236 0.750681997176} H5 12 1 1 {} {0.327626860166 0.540548172924 0.860481804111} H6 13 1 1 {} {0.399325383308 0.675919545442 0.321358215619} H7 14 1 1 {} {0.637637670631 0.707246496697 0.276058079828} H8 15 1 1 {} {0.557963204143 0.685764185595 0.504662542721} H10 16 1 8 {} {0.267382782249 0.641782762038 0.628630844458} O 17 1 1 {} {0.355337515047 0.678242586656 0.609040084119} 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