%chk=000271075.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000271075

0 1
O 0.001878 3.735184 0.000163
N 0.502986 1.692463 -1.046867
N -0.501368 1.692907 1.047025
C 0.449913 0.252324 -0.646892
C -0.449822 0.252747 0.646938
C 1.819446 -0.331665 -0.383152
C -1.819972 -0.329761 0.383142
C 0.001248 2.524610 0.000117
C 2.672139 0.242348 0.571683
C -2.672046 0.245242 -0.571648
C 2.240521 -1.457388 -1.104201
C -2.242246 -1.455096 1.104090
C 3.936630 -0.305495 0.799419
C -3.937118 -0.301236 -0.799437
C 3.506228 -2.004092 -0.871352
C -3.508532 -2.000434 0.871187
C 4.355655 -1.429103 0.078644
C -4.357341 -1.424459 -0.078762
H -0.062249 -0.303875 -1.475932
H 0.061741 -0.304069 1.475933
H 1.324699 2.002222 -1.563084
H -1.322724 2.003496 1.563308
H 2.346618 1.115557 1.140145
H -2.345593 1.118152 -1.140033
H 1.586056 -1.910973 -1.847532
H -1.588269 -1.909443 1.847384
H 4.596868 0.143952 1.540367
H -4.596872 0.148978 -1.540350
H 3.830197 -2.879127 -1.433087
H -3.833434 -2.875173 1.432844
H 5.341859 -1.854652 0.257501
H -5.343996 -1.848943 -0.257662


%chk=000271075-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000271075

0 1
O 0.002224 4.347901 0.000298
N 0.953792 2.240542 -0.589676
N -0.951601 2.241494 0.589989
C 0.543142 0.825154 -0.582728
C -0.542471 0.825667 0.582880
C 1.676760 -0.161616 -0.343384
C -1.677148 -0.159858 0.343431
C 0.001516 3.088458 0.000163
C 2.749856 0.156273 0.527169
C -2.749950 0.159287 -0.527024
C 1.647194 -1.433134 -0.966923
C -1.648841 -1.431529 0.966716
C 3.776194 -0.783118 0.767810
C -3.777249 -0.779019 -0.767811
C 2.670343 -2.376624 -0.722352
C -2.672950 -2.373936 0.721988
C 3.738778 -2.053713 0.145592
C -3.741091 -2.049776 -0.145851
H 0.023014 0.559338 -1.528452
H -0.022618 0.559192 1.528569
H 1.630026 2.616386 -1.251975
H -1.627421 2.618030 1.252315
H 2.779547 1.146478 0.996371
H -2.778630 1.149603 -0.996052
H 0.819958 -1.685389 -1.642030
H -0.821831 -1.684753 1.641737
H 4.605662 -0.525986 1.436250
H -4.606478 -0.520915 -1.436174
H 2.636981 -3.356887 -1.210698
H -2.640556 -3.354334 1.210131
H 4.536646 -2.781399 0.331568
H -4.539698 -2.776621 -0.331947


