#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 {} {0.46914407966 0.229378937442 0.481756080933} O1 1 1 14 {} {0.33124368491 0.233647219713 0.569368203588} Si1 2 1 14 {} {0.602332195289 0.31668518297 0.437303662308} Si2 3 1 8 {} {0.555036501347 0.466936997932 0.382253218623} O2 4 1 8 {} {0.331561998312 0.371936994098 0.666211932562} O3 5 1 14 {} {0.278152229171 0.525798904687 0.699023989473} Si3 6 1 14 {} {0.510504769045 0.634425667346 0.400602199555} Si4 7 1 1 {} {0.328613677352 0.115613195859 0.659906743042} H1 8 1 1 {} {0.214582514265 0.238035290403 0.476565198553} H2 9 1 1 {} {0.668014958187 0.23887984532 0.327520309774} H3 10 1 1 {} {0.693839584896 0.330674842938 0.555328519069} H4 11 1 1 {} {0.126004240214 0.506917041742 0.712367580284} H5 12 1 1 {} {0.34415330549 0.550082902562 0.836039023856} H6 13 1 1 {} {0.367483799584 0.763076699668 0.375488243651} H7 14 1 1 {} {0.5675499289 0.693544957429 0.279306759438} H8 15 1 1 {} {0.582776566288 0.678871327147 0.525558946015} H10 16 1 8 {} {0.319977453537 0.641338512824 0.584299356375} O 17 1 1 {} {0.319114648765 0.736673444663 0.562158035353} 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