%chk=000292037.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000292037

0 1
O -4.233204 0.757702 0.000087
N -0.327172 -0.343424 -0.000142
N 0.365868 1.855473 -0.000685
N -2.037541 1.421640 0.000097
C 1.102106 -0.350713 -0.000231
C 1.519591 1.029554 -0.000265
C -0.787562 1.042780 -0.000071
C -1.306397 -1.366317 0.000000
C 2.044793 -1.371132 -0.000208
C 2.866216 1.377467 -0.000243
C -2.610514 -0.987076 0.000131
C -0.847218 -2.780440 -0.000056
C 3.399480 -1.007279 -0.000201
C 3.801017 0.333822 -0.000221
C -3.074914 0.415508 0.000165
H 0.346027 2.864430 0.001076
H 1.758446 -2.419220 -0.000198
H 3.183925 2.417147 -0.000241
H -3.413860 -1.724515 0.000184
H -1.697719 -3.483360 -0.000048
H -0.245820 -3.018935 0.891800
H -0.245886 -3.018887 -0.891977
H 4.156535 -1.792108 -0.000217
H 4.864902 0.575285 -0.000236


%chk=000292037-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000292037

0 1
O -4.290735 0.775811 0.001056
N -0.323371 -0.337505 -0.000260
N 0.355022 1.813411 -0.000011
N -2.029729 1.438893 -0.000140
C 1.100381 -0.347519 -0.000246
C 1.514491 1.023991 -0.000070
C -0.787739 1.014758 -0.000110
C -1.300113 -1.357756 -0.000151
C 2.060625 -1.379326 -0.000352
C 2.871717 1.387909 -0.000067
C -2.621369 -0.965031 -0.000136
C -0.853528 -2.797670 0.000050
C 3.428156 -1.012692 -0.000312
C 3.829220 0.346375 -0.000179
C -3.067607 0.448997 -0.000678
H 0.295006 2.829090 0.000397
H 1.782702 -2.434351 -0.000472
H 3.179341 2.438151 0.000026
H -3.405610 -1.726199 0.000178
H -1.738389 -3.451922 0.000091
H -0.250319 -3.037788 0.895333
H -0.250212 -3.038021 -0.895099
H 4.188146 -1.800665 -0.000390
H 4.895012 0.596463 -0.000159


