%chk=000188100.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000188100

1 1
N -2.961060 -1.374318 0.254433
C -2.270646 -0.824116 -1.020759
C -2.065019 -2.427381 0.918533
C -4.296382 -2.013363 -0.190511
C -3.328117 -0.240920 1.237392
C -1.072199 0.036526 -0.763184
C 0.196475 -0.521972 -0.644240
C -1.240228 1.467395 -0.697053
C 1.307845 0.304559 -0.238063
C -2.702860 -3.108432 2.115754
C -4.139344 -3.162888 -1.168573
C -2.221766 0.185958 2.184435
C 1.135492 1.686401 -0.041439
C -0.147653 2.286842 -0.311488
C 2.604481 -0.294096 -0.018924
C 0.467602 -1.928152 -0.922313
C 2.810006 -1.687961 -0.249840
C 3.689943 0.502577 0.428460
C -2.479230 2.099487 -1.033854
C 2.254637 2.474672 0.414206
C 1.691844 -2.474716 -0.743663
C -0.337931 3.701321 -0.222056
C 3.473143 1.913015 0.641599
C -2.629062 3.463409 -0.954281
C 4.066745 -2.252538 -0.025161
C 4.951789 -0.098156 0.649627
C -1.546357 4.278051 -0.527032
C 5.132686 -1.455570 0.427248
H -3.037993 -0.251162 -1.602424
H -1.990613 -1.696828 -1.662758
H -1.789986 -3.189755 0.151297
H -1.106929 -1.931817 1.218653
H -4.835438 -2.370284 0.720901
H -4.933103 -1.215396 -0.641272
H -3.663084 0.639079 0.636258
H -4.206359 -0.574020 1.840854
H -1.987834 -3.818570 2.568744
H -2.980133 -2.412245 2.919493
H -3.592586 -3.699559 1.861662
H -5.130151 -3.591297 -1.408495
H -3.704648 -2.867156 -2.132922
H -3.543735 -3.996706 -0.771504
H -2.518544 1.108032 2.714682
H -1.999602 -0.557957 2.960842
H -1.274943 0.431408 1.679365
H -0.341554 -2.523639 -1.345283
H -3.303368 1.487383 -1.400909
H 2.100986 3.546262 0.570323
H 1.883552 -3.525117 -0.979611
H 0.506777 4.325233 0.086639
H 4.316164 2.517373 0.986206
H -3.572443 3.940570 -1.226486
H 4.233420 -3.316551 -0.202525
H 5.785547 0.516816 0.995315
H -1.686211 5.358128 -0.461432
H 6.109172 -1.913759 0.598334


%chk=000188100-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000188100

1 1
N -3.012841 -1.432684 0.293351
C -2.206831 -0.886345 -0.978583
C -2.234054 -2.592482 0.945137
C -4.396854 -1.912844 -0.222701
C -3.308232 -0.303142 1.328246
C -1.024054 0.012729 -0.724448
C 0.283181 -0.537543 -0.573019
C -1.214954 1.452440 -0.694882
C 1.403090 0.331119 -0.226969
C -2.968291 -3.305953 2.088483
C -4.374734 -3.017840 -1.285223
C -2.192196 0.049770 2.318413
C 1.205218 1.745922 -0.084023
C -0.100417 2.321490 -0.364863
C 2.714816 -0.233395 -0.016156
C 0.573845 -1.950460 -0.763711
C 2.948720 -1.643959 -0.189723
C 3.818859 0.609414 0.366367
C -2.476496 2.074590 -1.004159
C 2.326034 2.560709 0.315138
C 1.838849 -2.474787 -0.592263
C -0.313460 3.738640 -0.337633
C 3.581260 2.017121 0.534639
C -2.646887 3.459538 -0.980103
C 4.246041 -2.178588 0.013027
C 5.108693 0.037516 0.569689
C -1.554547 4.304901 -0.630802
C 5.320223 -1.341702 0.392993
H -2.979352 -0.378658 -1.574348
H -1.921242 -1.799202 -1.519048
H -2.006481 -3.306415 0.136969
H -1.279197 -2.162725 1.283017
H -4.957702 -2.248742 0.664896
H -4.898597 -1.007792 -0.609078
H -3.584544 0.581197 0.732675
H -4.204750 -0.635968 1.879695
H -2.269483 -4.035113 2.535095
H -3.282841 -2.624228 2.896069
H -3.848396 -3.874206 1.743420
H -5.422500 -3.257005 -1.540165
H -3.880002 -2.712194 -2.220993
H -3.912809 -3.951771 -0.923437
H -2.566019 0.879558 2.945425
H -1.940699 -0.780287 2.998974
H -1.275554 0.400211 1.824122
H -0.215693 -2.627929 -1.100087
H -3.333142 1.468763 -1.317849
H 2.194964 3.635949 0.452666
H 2.021965 -3.540138 -0.774023
H 0.516718 4.407290 -0.099517
H 4.414636 2.661356 0.836213
H -3.615166 3.897611 -1.243408
H 4.412042 -3.252223 -0.130409
H 5.939156 0.688837 0.863786
H -1.684530 5.391256 -0.610590
H 6.316431 -1.767506 0.546912


