%chk=000191752.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191752

0 1
O 0.159412 2.684288 0.156698
O -2.092712 3.420253 0.090477
O 4.379706 0.985584 -0.407592
N -2.274997 -3.042155 0.131015
C -1.130896 -2.142157 -0.200469
C -1.462332 -0.659874 -0.091974
C 0.068168 -2.505127 0.700241
C -0.359412 0.246231 0.011232
C -2.785510 -0.217598 -0.139204
C -3.939837 -1.178878 -0.224784
C -3.505050 -2.610916 -0.585602
C 1.243530 -1.621655 0.399799
C 1.022591 -0.257924 0.071087
C -0.691573 1.587595 0.060113
C -3.105523 1.167942 -0.079247
C -2.046214 2.034247 0.018049
C 2.545522 -2.118478 0.462798
C 2.107927 0.576170 -0.191309
C 3.412071 0.044212 -0.122117
C -0.701049 3.868470 0.185781
C 3.647958 -1.293946 0.202884
C 5.762762 0.561529 -0.371119
H -0.853048 -2.345869 -1.273812
H 0.317762 -3.576706 0.557472
H -0.200233 -2.398089 1.772768
H -4.475494 -1.177623 0.748486
H -4.680082 -0.820924 -0.969637
H -2.447756 -3.037156 1.143681
H -4.315355 -3.333923 -0.351319
H -3.320688 -2.690431 -1.680332
H -4.133085 1.516342 -0.110265
H 2.717316 -3.164569 0.716710
H 1.974416 1.630591 -0.444853
H -0.478315 4.468955 -0.705900
H -0.570436 4.357922 1.159842
H 4.650853 -1.701373 0.256250
H 6.032426 0.228391 0.635016
H 6.288326 1.489525 -0.631714
H 5.943151 -0.214074 -1.120748


%chk=000191752-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000191752

0 1
O 0.142033 2.756619 0.035242
O -2.133858 3.479389 -0.050360
O 4.463369 0.997786 -0.464215
N -2.291158 -3.055983 0.133998
C -1.147152 -2.165435 -0.171265
C -1.480228 -0.662855 -0.093080
C 0.045896 -2.491975 0.744954
C -0.377048 0.263312 -0.015219
C -2.828271 -0.223185 -0.146163
C -3.985525 -1.221012 -0.208221
C -3.512551 -2.643912 -0.598291
C 1.236882 -1.610538 0.413949
C 1.018367 -0.241701 0.049399
C -0.726163 1.625239 -0.000077
C -3.133974 1.170354 -0.121659
C -2.066222 2.059316 -0.046745
C 2.555198 -2.099568 0.476731
C 2.131209 0.586543 -0.231812
C 3.446985 0.073568 -0.159398
C -0.752018 3.922646 0.250780
C 3.672078 -1.277687 0.196480
C 5.845401 0.522328 -0.396862
H -0.838789 -2.385327 -1.216930
H 0.301325 -3.561367 0.640086
H -0.265173 -2.330532 1.801449
H -4.482962 -1.263784 0.783760
H -4.752303 -0.861273 -0.922748
H -2.461702 -3.087888 1.151986
H -4.313147 -3.383526 -0.415347
H -3.275681 -2.677045 -1.679139
H -4.167462 1.526121 -0.164149
H 2.720693 -3.148384 0.750957
H 1.998308 1.634529 -0.507980
H -0.468231 4.723758 -0.448102
H -0.691415 4.231015 1.312617
H 4.681603 -1.694981 0.252412
H 6.105918 0.178950 0.623846
H 6.462770 1.393011 -0.663116
H 6.027295 -0.297724 -1.119366


