%chk=000224810.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000224810

0 1
O -2.334342 -2.453779 -2.155418
N 2.786334 -0.643219 1.121086
N -0.873603 0.048813 1.794934
N -2.985081 1.806448 1.352558
C 3.886629 -0.177038 0.224324
C 5.176605 -0.910420 0.654521
C 3.601435 -0.422452 -1.277339
C 6.364354 -0.459347 -0.204163
C 4.793031 0.026795 -2.132202
C 6.088314 -0.674314 -1.698899
C 1.523815 0.160254 1.030186
C 0.466417 -0.558453 1.917003
C 1.760658 1.617573 1.485059
C 2.247801 1.752458 2.923713
C -1.685627 -0.158167 0.689029
C -2.835436 0.723523 0.499241
C -1.486895 -1.214585 -0.203735
C -3.755820 0.454233 -0.555078
C -2.427250 -1.435682 -1.234145
C -3.548638 -0.636705 -1.426787
C -4.880324 1.341153 -0.688787
C -4.032900 2.604826 1.189690
C -5.021506 2.398298 0.168421
C -1.230148 -3.383538 -2.052210
H 4.025172 0.923897 0.391229
H 5.044720 -2.005008 0.572739
H 5.375855 -0.708824 1.724713
H 2.690740 0.121706 -1.586901
H 3.396994 -1.493523 -1.457017
H 6.582683 0.608999 -0.012693
H 7.273529 -1.013792 0.095037
H 4.917528 1.124286 -2.055345
H 4.589642 -0.182790 -3.199087
H 6.938698 -0.298650 -2.297576
H 6.017105 -1.757722 -1.913538
H 2.584110 -1.632477 0.940881
H 1.131416 0.195135 -0.023316
H 0.412006 -1.640812 1.662384
H 0.773150 -0.510786 2.988376
H 0.824282 2.193833 1.345989
H 2.501860 2.086503 0.803731
H 2.568265 2.776953 3.140100
H 3.103574 1.086883 3.110029
H 1.469727 1.489737 3.647762
H -1.012932 0.911029 2.332144
H -0.633780 -1.870675 -0.092342
H -4.244079 -0.850111 -2.230834
H -5.602896 1.147297 -1.480656
H -4.128224 3.453183 1.875512
H -5.859925 3.087239 0.096982
H -1.267119 -3.912877 -1.095796
H -1.434919 -4.066655 -2.887210
H -0.280305 -2.861850 -2.196601


%chk=000224810-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000224810

0 1
O -2.345943 -2.263760 -2.375045
N 2.806619 -0.499805 1.133361
N -0.858141 0.262972 1.622248
N -3.197808 1.592332 1.618531
C 4.001412 -0.225741 0.295878
C 5.183131 -1.078532 0.814867
C 3.796614 -0.465264 -1.229339
C 6.481473 -0.819356 0.013476
C 5.092936 -0.190456 -2.030717
C 6.268956 -1.045415 -1.502491
C 1.562971 0.265532 0.872272
C 0.464929 -0.318016 1.811930
C 1.762757 1.788982 1.088137
C 2.287243 2.186252 2.484715
C -1.747986 -0.064423 0.619847
C -3.015997 0.649154 0.625743
C -1.513412 -1.034831 -0.379068
C -4.009324 0.352578 -0.380982
C -2.518194 -1.308836 -1.356855
C -3.749273 -0.635016 -1.372733
C -5.233341 1.101932 -0.307017
C -4.361994 2.271478 1.649729
C -5.409870 2.054454 0.699492
C -1.088299 -3.009537 -2.421510
H 4.270398 0.841645 0.438680
H 4.911829 -2.154230 0.730740
H 5.333674 -0.866971 1.890037
H 2.973716 0.171179 -1.609951
H 3.487754 -1.522676 -1.380732
H 6.809985 0.227189 0.182313
H 7.292994 -1.471760 0.390078
H 5.355752 0.884471 -1.941869
H 4.925037 -0.387893 -3.107425
H 7.196648 -0.809072 -2.059069
H 6.049196 -2.118286 -1.684087
H 2.622235 -1.513575 1.177540
H 1.195635 0.140321 -0.177002
H 0.412211 -1.418452 1.660271
H 0.777628 -0.161420 2.858894
H 0.790639 2.280578 0.889325
H 2.458701 2.168745 0.314207
H 2.507587 3.268629 2.525735
H 3.208368 1.628488 2.728120
H 1.548943 1.970836 3.279282
H -1.208504 0.990973 2.255461
H -0.561472 -1.570393 -0.402299
H -4.485485 -0.875377 -2.144864
H -6.019744 0.915254 -1.047484
H -4.477386 3.013096 2.448419
H -6.334355 2.636116 0.773185
H -0.935471 -3.605826 -1.500627
H -1.189553 -3.684401 -3.284459
H -0.221723 -2.337063 -2.577191


