%chk=000217768.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217768

0 1
N 1.925226 3.588632 1.175528
C 0.116013 0.573443 -0.096205
C 0.672699 1.437181 1.069285
C 0.274937 1.486796 -1.350646
C 1.785138 2.300022 0.434153
C 1.327398 2.558439 -1.022273
C -1.360112 0.212434 0.028611
C 0.955379 -0.702840 -0.148903
C -2.194757 0.792894 0.991617
C 0.651320 -1.756244 0.732809
C -1.909860 -0.709192 -0.881477
C 2.052552 -0.838030 -1.009521
C -3.550433 0.454004 1.054314
C 1.418951 -2.921409 0.738934
C -3.262500 -1.045745 -0.818774
C 2.821281 -2.007189 -1.002474
C -4.088071 -0.465896 0.151507
C 2.507362 -3.052142 -0.131104
H 1.043420 0.824145 1.903512
H -0.119290 2.093314 1.486407
H -0.692253 1.969768 -1.586387
H 0.541700 0.903564 -2.245907
H 2.741555 1.717294 0.423223
H 2.177612 2.525300 -1.719839
H 0.885345 3.569263 -1.114715
H 2.647666 4.168143 0.760323
H 2.188737 3.423334 2.141734
H -1.790617 1.523318 1.695834
H -0.195407 -1.665740 1.413816
H -1.272234 -1.168512 -1.636519
H 2.319997 -0.032367 -1.691717
H -4.186647 0.912396 1.809413
H 1.169708 -3.731118 1.422620
H -3.676525 -1.761775 -1.526564
H 3.668198 -2.099516 -1.679958
H -5.141939 -0.729727 0.200102
H 3.104052 -3.961142 -0.126957


%chk=000217768-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000217768

0 1
N 2.143671 3.488591 1.188687
C 0.050118 0.631983 -0.098872
C 0.550812 1.564734 1.049479
C 0.248054 1.581235 -1.335429
C 1.830896 2.223446 0.483786
C 1.492458 2.470525 -1.020812
C -1.428466 0.207948 0.014088
C 0.943632 -0.634713 -0.144618
C -2.284728 0.648973 1.053802
C 0.792134 -1.613274 0.875878
C -1.975817 -0.643841 -0.984355
C 1.930869 -0.861261 -1.136066
C -3.645706 0.262180 1.090617
C 1.597752 -2.770067 0.908599
C -3.332385 -1.027422 -0.955353
C 2.738628 -2.023065 -1.111889
C -4.178025 -0.573695 0.085139
C 2.579161 -2.982504 -0.088732
H 0.720029 1.025818 1.999701
H -0.180275 2.376247 1.227056
H -0.653019 2.214584 -1.418180
H 0.333291 1.026898 -2.286793
H 2.662975 1.483610 0.544901
H 2.353537 2.228939 -1.670567
H 1.251699 3.540249 -1.160369
H 2.910644 4.013636 0.751368
H 2.319162 3.358371 2.192492
H -1.898043 1.296183 1.847683
H 0.021995 -1.470725 1.643859
H -1.324783 -1.017364 -1.784172
H 2.081564 -0.133961 -1.940685
H -4.287165 0.614643 1.906778
H 1.456324 -3.509379 1.705504
H -3.729942 -1.682682 -1.739038
H 3.492581 -2.175122 -1.893144
H -5.232094 -0.872135 0.112656
H 3.204061 -3.882483 -0.069196


