#MD System 2.0 @Title neb0_image05 @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 {} {0.473070333732 0.240520446342 0.487621477129} O1 1 1 14 {} {0.327068981356 0.226472036553 0.563439124066} Si1 2 1 14 {} {0.600799671303 0.342288908088 0.466118085651} Si2 3 1 8 {} {0.552914220874 0.497072088441 0.492804820964} O2 4 1 8 {} {0.285552558917 0.363045678998 0.642492484716} O3 5 1 14 {} {0.248136508319 0.521614073792 0.664928393846} Si3 6 1 14 {} {0.558908731959 0.652638654094 0.440521352811} Si4 7 1 1 {} {0.338984211767 0.115640384472 0.662382063684} H1 8 1 1 {} {0.224795304789 0.196651364207 0.459872858438} H2 9 1 1 {} {0.645339814269 0.332627085046 0.324273953957} H3 10 1 1 {} {0.708887717999 0.31098040078 0.564299610699} H4 11 1 1 {} {0.133625255782 0.522082687328 0.759404257407} H5 12 1 1 {} {0.369153751627 0.595825856496 0.714451548293} H6 13 1 1 {} {0.467593912799 0.729042305651 0.530997210648} H7 14 1 1 {} {0.514109293123 0.667077468684 0.297897269216} H8 15 1 1 {} {0.699279591574 0.705145185852 0.448918576679} H10 16 1 8 {} {0.199363908368 0.593728080571 0.522878970962} O 17 1 1 {} {0.26250224605 0.660065263148 0.487756094798} 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