%chk=000213626.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000213626

0 1
O 4.136987 -2.002948 -0.714035
N -1.483356 -1.836955 0.142854
N 2.118745 -1.007835 -0.373214
N -7.160772 -0.457764 1.173821
N 4.580022 2.578498 -0.180762
C 1.365725 -2.282830 -0.516988
C 0.271228 -2.140171 -1.592246
C 0.741850 -2.706809 0.827121
C -0.914467 -1.282291 -1.128615
C -0.454061 -1.834533 1.234155
C -2.703719 -1.073886 0.565454
C -3.904490 -1.538184 -0.284459
C -5.151731 -0.870106 0.163736
C 3.514447 -0.973771 -0.485625
C -5.553301 0.479261 -0.164354
C 4.145713 0.344722 -0.311550
C -6.139329 -1.412891 0.972179
C -6.815827 0.711780 0.480849
C 5.546527 0.508162 0.001709
C -4.980922 1.508154 -0.934963
C 3.591432 1.616235 -0.423268
C 5.797433 1.915883 0.085917
C -7.497267 1.941741 0.367738
C -5.652492 2.713663 -1.043816
C 6.604196 -0.398110 0.211055
C -6.899064 2.926532 -0.397113
C 7.074476 2.429229 0.386078
C 7.856823 0.110294 0.504179
C 8.087952 1.509392 0.592758
H 2.101173 -3.074084 -0.842727
H -0.094357 -3.155811 -1.850856
H 0.697978 -1.719810 -2.522027
H 1.506676 -2.691133 1.626367
H 0.409114 -3.761856 0.738421
H -1.715329 -1.316799 -1.901184
H -0.606643 -0.218977 -1.036642
H -0.109882 -0.813424 1.503344
H -0.924949 -2.266091 2.145406
H -2.586139 0.027725 0.488395
H -2.916588 -1.292859 1.634876
H 1.584119 -0.192938 -0.107098
H -3.721882 -1.327031 -1.358943
H -3.994477 -2.643704 -0.218819
H -6.193845 -2.392286 1.412174
H -7.991285 -0.600551 1.711426
H -4.028408 1.342939 -1.432492
H 2.580511 1.898146 -0.666914
H -8.449420 2.099720 0.861478
H 4.451602 3.571305 -0.209020
H -5.230249 3.522850 -1.635173
H 6.408026 -1.470562 0.125392
H -7.387091 3.893320 -0.514981
H 7.249199 3.497373 0.449221
H 8.693769 -0.566368 0.669700
H 9.094020 1.855646 0.827581


%chk=000213626-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000213626

0 1
O 4.141185 -2.166542 -0.103874
N -1.435943 -1.921058 0.026193
N 2.123203 -1.165852 -0.674671
N -7.147046 -0.412445 1.194957
N 4.543065 2.442610 -0.793716
C 1.391191 -2.450520 -0.716727
C 0.249517 -2.390049 -1.758286
C 0.803076 -2.823225 0.669884
C -0.917201 -1.490502 -1.292657
C -0.363837 -1.896534 1.056803
C -2.635545 -1.160054 0.453211
C -3.913410 -1.549650 -0.337775
C -5.145331 -0.834848 0.162204
C 3.482994 -1.109861 -0.386013
C -5.477414 0.571661 -0.014919
C 4.118868 0.229633 -0.423687
C -6.186840 -1.395094 0.901597
C -6.737721 0.807007 0.644063
C 5.435697 0.543811 0.113997
C -4.841081 1.655593 -0.678455
C 3.616069 1.416638 -0.976131
C 5.672622 1.940784 -0.125741
C -7.360058 2.075228 0.660948
C -5.457122 2.921713 -0.668388
C 6.428818 -0.222123 0.779864
C -6.702555 3.130296 -0.003283
C 6.858762 2.592627 0.277658
C 7.613118 0.421819 1.186081
C 7.827091 1.811039 0.939152
H 2.134796 -3.214170 -1.005314
H -0.141137 -3.414063 -1.904215
H 0.638100 -2.033280 -2.730983
H 1.602433 -2.774519 1.430844
H 0.434266 -3.865915 0.626922
H -1.731116 -1.540428 -2.037362
H -0.585895 -0.412327 -1.260105
H 0.024181 -0.854384 1.214584
H -0.799160 -2.226611 2.018068
H -2.472290 -0.054298 0.380630
H -2.814770 -1.382293 1.521901
H 1.587967 -0.301226 -0.763168
H -3.769872 -1.330049 -1.414358
H -4.038179 -2.644961 -0.253085
H -6.314439 -2.422874 1.237513
H -8.007424 -0.566097 1.715129
H -3.885670 1.508808 -1.195410
H 2.683990 1.606423 -1.507348
H -8.318093 2.239423 1.167154
H 4.428718 3.401399 -1.115669
H -4.977629 3.765035 -1.177982
H 6.260523 -1.288465 0.951343
H -7.155859 4.127898 -0.011147
H 7.026487 3.658607 0.087883
H 8.392128 -0.152708 1.699336
H 8.762173 2.278175 1.268050


