%chk=000211330.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000211330

0 1
O 1.487447 0.122790 -0.358856
O 1.572984 -3.397244 1.664188
N -0.402000 2.915201 -1.753003
C -0.136828 1.669830 -0.971529
C -1.666084 2.822858 -2.541501
C -0.340331 4.133225 -0.878274
C 1.373019 1.397700 -1.073617
C -1.043374 -2.526192 1.289871
C 0.141255 -1.717984 0.751797
C -2.316990 -1.739865 1.133792
C 2.689885 -1.715441 0.456221
C 1.474125 -2.371462 1.017235
C 2.708545 -0.481063 -0.234042
C -2.951990 2.625313 -1.736269
C -0.138046 5.382807 -1.736011
C -2.798623 -0.892750 2.155169
C -3.027549 -1.835420 -0.072042
C 3.918165 -2.380635 0.629354
C 3.901839 0.065873 -0.738563
C -3.978541 -0.162172 1.944407
C -2.080131 -0.763072 3.460033
C -4.199606 -1.102306 -0.272845
C 5.108877 -1.850865 0.135882
C 5.094968 -0.628584 -0.548100
C -4.675243 -0.263457 0.738003
H -0.447294 1.725691 0.093599
H -0.691201 0.802265 -1.395654
H -1.540080 1.987272 -3.266697
H -1.741763 3.750985 -3.152329
H 0.523406 4.022749 -0.185673
H -1.244982 4.249548 -0.242013
H 1.708613 1.259254 -2.114299
H 1.987744 2.152415 -0.560180
H -1.109201 -3.498701 0.758526
H -0.860711 -2.809444 2.348121
H 0.144856 -0.694522 1.192963
H 0.021589 -1.542536 -0.341227
H -2.947016 1.686091 -1.169048
H -3.112337 3.437120 -1.017977
H -3.826568 2.597250 -2.395601
H 0.682055 5.241544 -2.452857
H -1.033468 5.630720 -2.317149
H 0.106099 6.249906 -1.113496
H -2.661785 -2.491166 -0.861144
H 3.916797 -3.336827 1.167959
H 3.905120 1.011649 -1.270159
H -4.358121 0.488357 2.730090
H -2.101076 -1.711970 4.017454
H -1.023183 -0.497107 3.316653
H -2.519995 0.001003 4.112940
H -4.741599 -1.189545 -1.211639
H 6.045080 -2.384433 0.281086
H 6.027072 -0.214260 -0.936050
H -5.589722 0.306808 0.589601


%chk=000211330-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000211330

0 1
O 1.398054 0.160685 -0.466900
O 1.651642 -3.484042 1.696009
N -0.290249 3.162072 -1.903309
C -0.148334 1.843087 -1.243943
C -1.473035 3.267691 -2.797073
C -0.099882 4.298225 -0.963244
C 1.330945 1.425244 -1.230504
C -1.031668 -2.735489 1.537973
C 0.056672 -1.847980 0.887581
C -2.409333 -2.105160 1.385336
C 2.659183 -1.701045 0.443077
C 1.467784 -2.406395 1.048281
C 2.633986 -0.469430 -0.291109
C -2.861720 3.246774 -2.101434
C 0.148421 5.641827 -1.672715
C -2.920368 -1.173735 2.342074
C -3.192074 -2.413710 0.243488
C 3.920610 -2.334717 0.626096
C 3.836275 0.078423 -0.812247
C -4.189866 -0.583244 2.115062
C -2.142056 -0.821580 3.600350
C -4.454803 -1.818850 0.026951
C 5.112960 -1.795607 0.113536
C 5.064693 -0.581147 -0.610490
C -4.956883 -0.893976 0.969372
H -0.539122 1.830995 -0.200306
H -0.722706 1.084914 -1.805981
H -1.414623 2.430878 -3.518957
H -1.373642 4.194163 -3.391816
H 0.782562 4.063168 -0.337920
H -0.960995 4.402245 -0.256834
H 1.695729 1.270131 -2.263703
H 1.958495 2.193772 -0.736742
H -1.008868 -3.732291 1.061190
H -0.772145 -2.901074 2.598377
H 0.033615 -0.820165 1.299554
H -0.150221 -1.700743 -0.190164
H -3.002601 2.324429 -1.508041
H -2.995183 4.111814 -1.426509
H -3.665914 3.286302 -2.859600
H 0.988323 5.550183 -2.384021
H -0.739866 5.987976 -2.230883
H 0.397881 6.422689 -0.931060
H -2.802608 -3.138790 -0.482627
H 3.916345 -3.272965 1.190994
H 3.817608 1.015569 -1.374837
H -4.583700 0.127419 2.852556
H -1.991373 -1.708149 4.245582
H -1.136414 -0.421941 3.370783
H -2.677480 -0.061960 4.195555
H -5.041815 -2.078997 -0.861314
H 6.066051 -2.309898 0.271817
H 5.982504 -0.144382 -1.020162
H -5.936689 -0.426014 0.819951


