%chk=000237294.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000237294

0 1
O 0.842310 0.176121 0.049899
O -5.217266 1.849684 0.291750
O 1.191726 -2.082477 0.082089
O 7.998435 -0.406572 -0.233596
O 7.467969 1.690785 -0.150012
N 7.191715 0.504298 -0.170547
C -7.174112 -0.090653 0.195504
C -5.694128 -0.493041 0.203220
C -8.092758 -1.318226 0.175174
C -4.786376 0.716256 0.236441
C -3.309113 0.472507 0.190725
C -9.564631 -0.912358 0.165771
C -2.740316 -0.805431 0.254714
C -2.472322 1.602518 0.083507
C -0.555744 0.163653 0.099967
C -1.353094 -0.975818 0.210129
C -1.089723 1.462519 0.034732
C 3.065733 -0.544728 -0.009165
C 1.637114 -0.966388 0.046827
C 4.036395 -1.557598 -0.080951
C 3.436635 0.807246 0.010667
C 5.748812 0.137101 -0.113975
C 5.388630 -1.217467 -0.134062
C 4.788377 1.154532 -0.042015
H -7.379354 0.560309 -0.678309
H -7.392990 0.542093 1.079739
H -5.465576 -1.107705 -0.691731
H -5.484623 -1.139615 1.080284
H -7.889041 -1.959485 1.055016
H -7.872887 -1.942352 -0.713059
H -10.218702 -1.791334 0.152068
H -9.811355 -0.305874 -0.713631
H -9.826917 -0.321842 1.051559
H -3.370789 -1.692259 0.343165
H -2.930418 2.598342 0.040445
H -0.914882 -1.976075 0.259355
H -0.430141 2.323527 -0.049885
H 3.728086 -2.609172 -0.094180
H 2.666728 1.584815 0.066867
H 6.163632 -1.991470 -0.190542
H 5.101363 2.205534 -0.027753


%chk=000237294-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000237294

0 1
O 0.871462 0.232084 0.028862
O -5.316550 1.934208 0.176045
O 1.276135 -2.090794 0.010796
O 8.151913 -0.556646 -0.123485
O 7.649394 1.668767 -0.107146
N 7.313128 0.423257 -0.103741
C -7.273331 -0.106064 0.211175
C -5.775517 -0.462532 0.176974
C -8.174560 -1.361013 0.224954
C -4.850391 0.756869 0.160798
C -3.360716 0.536277 0.125860
C -9.677872 -1.010774 0.257182
C -2.772263 -0.754821 0.107627
C -2.507823 1.674888 0.110319
C -0.553894 0.224831 0.060450
C -1.372473 -0.929672 0.074849
C -1.113657 1.525083 0.077777
C 3.134337 -0.517699 -0.021862
C 1.692411 -0.911032 0.006782
C 4.096427 -1.562228 -0.044581
C 3.554041 0.838498 -0.026334
C 5.860923 0.095187 -0.075237
C 5.469654 -1.261685 -0.071393
C 4.925457 1.152470 -0.053211
H -7.519668 0.526277 -0.663109
H -7.481617 0.518140 1.100999
H -5.552483 -1.086724 -0.714210
H -5.513639 -1.093064 1.052979
H -7.922391 -1.987219 1.105738
H -7.958480 -1.980605 -0.669918
H -10.306062 -1.920242 0.270414
H -9.964425 -0.413979 -0.629011
H -9.925894 -0.414652 1.155403
H -3.403138 -1.649161 0.118620
H -2.970676 2.666722 0.124332
H -0.930485 -1.925556 0.060752
H -0.445886 2.391439 0.065538
H 3.747082 -2.599206 -0.040668
H 2.804031 1.632120 -0.008644
H 6.232787 -2.043616 -0.089134
H 5.281113 2.185765 -0.057341


