%chk=000189505.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000189505

0 1
O -1.150467 -0.436316 -1.206652
O 1.165006 3.291605 0.923398
N -2.003350 -0.639706 0.876139
N -6.367034 0.288253 -0.075085
C -3.074581 -1.591701 0.446188
C -3.447521 -2.344526 1.742624
C -3.025827 -1.438364 2.914361
C -2.024790 -0.411360 2.346221
C -1.084849 -0.106079 -0.027834
C -4.212037 -0.827473 -0.200696
C -0.047791 0.842141 0.530444
C 0.700879 1.552045 -0.601010
C 1.811926 2.471632 -0.079562
C 2.998862 1.740724 0.568509
C 3.883621 1.051386 -0.475138
C 5.089251 0.363412 0.179511
C -4.123444 -0.504245 -1.565075
C -5.347234 -0.394389 0.508013
C 5.969318 -0.335385 -0.865681
C 7.176881 -1.021181 -0.213038
C -5.163301 0.197364 -2.175855
C 8.057239 -1.721966 -1.257522
C -6.272756 0.572465 -1.399313
C 9.261183 -2.406223 -0.613952
H -2.638957 -2.300795 -0.310259
H -4.519312 -2.599165 1.783461
H -2.905640 -3.307284 1.784719
H -2.573528 -2.028763 3.728886
H -3.902143 -0.926653 3.350658
H -1.010298 -0.554477 2.772304
H -2.342373 0.630195 2.566621
H 0.665251 0.284924 1.173062
H -0.507698 1.613723 1.188957
H -0.022297 2.150240 -1.195321
H 1.121699 0.806893 -1.308091
H 2.162756 3.149562 -0.891568
H 2.626531 1.001944 1.305264
H 3.597373 2.460905 1.158813
H 4.233581 1.788236 -1.224138
H 3.288065 0.305825 -1.039735
H 4.741602 -0.372820 0.929877
H 5.689389 1.105257 0.740774
H -3.226878 -0.782787 -2.133168
H 6.315384 0.398367 -1.619041
H 5.370489 -1.080608 -1.424614
H -5.462349 -0.587275 1.580321
H 6.833111 -1.756052 0.540059
H 7.778048 -0.278226 0.345368
H 1.769953 3.981412 1.247414
H -5.113647 0.456041 -3.230558
H 7.457835 -2.467976 -1.815402
H 8.403593 -0.988198 -2.011478
H -7.114872 1.121274 -1.834735
H 9.882963 -2.903472 -1.366893
H 8.952924 -3.167892 0.111224
H 9.898368 -1.688869 -0.084477


%chk=000189505-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000189505

0 1
O -1.310539 -0.043947 -1.576168
O 1.106657 3.612802 0.646297
N -1.902100 -0.590846 0.600873
N -6.591839 -0.140810 0.435865
C -2.982665 -1.537756 0.163123
C -3.028414 -2.532659 1.349105
C -2.689017 -1.670946 2.594996
C -1.664603 -0.631646 2.068756
C -1.105022 0.067246 -0.321122
C -4.297796 -0.811270 -0.162050
C 0.035188 0.914360 0.254369
C 0.730666 1.753906 -0.832401
C 1.814901 2.695579 -0.281570
C 2.999245 2.009811 0.437844
C 3.809274 1.052315 -0.466051
C 5.074968 0.492604 0.221297
C -4.426273 -0.126051 -1.400577
C -5.418099 -0.788047 0.707878
C 5.876582 -0.473465 -0.680068
C 7.139189 -1.045449 0.002864
C -5.629218 0.546832 -1.700111
C 7.940307 -2.007865 -0.903723
C -6.681460 0.518618 -0.756148
C 9.200369 -2.576853 -0.216481
H -2.629571 -2.020109 -0.767052
H -3.995919 -3.053432 1.435184
H -2.246258 -3.299751 1.201529
H -2.272024 -2.270417 3.421463
H -3.589776 -1.157885 2.973711
H -0.624449 -0.950576 2.278559
H -1.810989 0.362782 2.529508
H 0.760470 0.234665 0.749432
H -0.345817 1.588635 1.044495
H -0.028092 2.369894 -1.346589
H 1.164127 1.094511 -1.605035
H 2.222976 3.283331 -1.135437
H 2.625550 1.469631 1.329766
H 3.681263 2.801077 0.819209
H 4.104506 1.583400 -1.395646
H 3.166235 0.207144 -0.784436
H 4.784797 -0.032333 1.155633
H 5.729550 1.334760 0.529597
H -3.577151 -0.116436 -2.092490
H 6.171300 0.054598 -1.611112
H 5.219141 -1.311076 -0.994543
H -5.400776 -1.313058 1.669948
H 6.846087 -1.578093 0.931971
H 7.797955 -0.209490 0.319359
H 1.757293 4.266468 1.008112
H -5.753049 1.082963 -2.646505
H 7.281519 -2.842284 -1.220510
H 8.232424 -1.474505 -1.831424
H -7.630926 1.031542 -0.948878
H 9.752050 -3.263059 -0.885152
H 8.933621 -3.138689 0.698699
H 9.891744 -1.765074 0.079139


