#MD System 2.0 @Title neb0_image03 @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 {} {0.456923093959 0.267008337912 0.490645362434} O1 1 1 14 {} {0.32391741298 0.238185050589 0.58228729543} Si1 2 1 14 {} {0.582740952517 0.351302695997 0.429907888593} Si2 3 1 8 {} {0.533316859464 0.4948771284 0.368680640916} O2 4 1 8 {} {0.304840314047 0.350453037813 0.700129313015} O3 5 1 14 {} {0.256724273303 0.503540989596 0.738404906601} Si3 6 1 14 {} {0.564205619337 0.656449092148 0.361630821769} Si4 7 1 1 {} {0.340610427808 0.10597229485 0.649149834097} H1 8 1 1 {} {0.206191768879 0.239938415912 0.49020156125} H2 9 1 1 {} {0.641248759405 0.270177457174 0.320840312187} H3 10 1 1 {} {0.682816542829 0.376410963326 0.537095837893} H4 11 1 1 {} {0.10815354823 0.510407050187 0.736675483968} H5 12 1 1 {} {0.316766633727 0.53603002183 0.869292582017} H6 13 1 1 {} {0.436771408662 0.72473367329 0.325546026007} H7 14 1 1 {} {0.665247274063 0.683454470797 0.255511912007} H8 15 1 1 {} {0.614563618435 0.708636768791 0.491188153209} H10 16 1 8 {} {0.31675020332 0.617697735471 0.630329848672} O 17 1 1 {} {0.258297488001 0.63724287727 0.553539911859} 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