#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 {} {0.473274343386 0.239692560802 0.487222097404} O1 1 1 14 {} {0.327800691311 0.225771129289 0.564074095338} Si1 2 1 14 {} {0.599411576446 0.342625246054 0.466112240106} Si2 3 1 8 {} {0.549741052409 0.497411318417 0.493268575174} O2 4 1 8 {} {0.286732205177 0.363157499282 0.6430174229} O3 5 1 14 {} {0.249803035543 0.521646928079 0.664583591976} Si3 6 1 14 {} {0.558429924939 0.652636333118 0.43895220651} Si4 7 1 1 {} {0.339420268769 0.114276931218 0.663702362138} H1 8 1 1 {} {0.224428926383 0.198626875923 0.459402335043} H2 9 1 1 {} {0.644966268045 0.333911727401 0.323839937335} H3 10 1 1 {} {0.707702552819 0.312210815167 0.564707533822} H4 11 1 1 {} {0.134141793818 0.522726043279 0.757618912031} H5 12 1 1 {} {0.369090095303 0.595947615003 0.715891738327} H6 13 1 1 {} {0.465238608474 0.724343800926 0.53095737917} H7 14 1 1 {} {0.51636976984 0.668024752468 0.296993218478} H8 15 1 1 {} {0.698822070248 0.704889558902 0.449199132628} H10 16 1 8 {} {0.202128743115 0.592295557847 0.521354338246} O 17 1 1 {} {0.262584085144 0.662323266924 0.490161027619} 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