#MD System 2.0 @Title neb0_image04 @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 {} {0.469876548843 0.227272106415 0.481993964697} O1 1 1 14 {} {0.33178705979 0.236892332741 0.572743393236} Si1 2 1 14 {} {0.598879496737 0.321392128973 0.436676546362} Si2 3 1 8 {} {0.545204322606 0.474064137356 0.387404473893} O2 4 1 8 {} {0.331268621123 0.375844039145 0.663175694312} O3 5 1 14 {} {0.278715369261 0.526218737713 0.697533814037} Si3 6 1 14 {} {0.509296563167 0.642671085708 0.401252024972} Si4 7 1 1 {} {0.329405030087 0.114542439953 0.661408259953} H1 8 1 1 {} {0.21455872667 0.235582934611 0.477855624049} H2 9 1 1 {} {0.666584325127 0.240550189193 0.327665359417} H3 10 1 1 {} {0.693725367902 0.329980947834 0.554368946189} H4 11 1 1 {} {0.129691871768 0.512174345362 0.708999750154} H5 12 1 1 {} {0.342058668883 0.553745633666 0.83087653636} H6 13 1 1 {} {0.376554153955 0.752144600192 0.386804894321} H7 14 1 1 {} {0.567044996537 0.69086410904 0.276208914302} H8 15 1 1 {} {0.583434688234 0.678078572916 0.526726693839} H10 16 1 8 {} {0.324693883771 0.63326699522 0.582289815228} O 17 1 1 {} {0.317306439729 0.727232628857 0.557073301894} 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