%chk=000216143.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000216143

0 1
O -0.527154 -1.205894 -1.925016
O 6.441589 -1.509899 0.106091
N 0.274915 0.628936 -0.758021
N 3.840669 -0.333860 -0.026699
C -2.114487 0.272483 -0.666397
C -1.700962 1.534885 0.069168
C -0.746992 -0.250531 -1.219929
C -0.280306 1.690880 0.010631
C -3.070236 0.581625 -1.840431
C 1.718222 0.420773 -0.986062
C -2.708414 -0.811822 0.217652
C 2.369071 -0.258690 0.240102
C -2.469370 2.496403 0.697965
C 0.363337 2.766539 0.611288
C -2.515904 1.611399 -2.817582
C 4.620061 -0.341039 1.255597
C 4.179711 -1.554533 -0.831719
C -3.073317 -0.575493 1.548569
C -2.902527 -2.094299 -0.327804
C -1.825785 3.593475 1.304357
C -0.438149 3.718584 1.265299
C 6.118984 -0.359581 0.913126
C 5.688082 -1.544236 -1.123817
C -3.643146 -1.597860 2.316181
C -3.469712 -3.111257 0.440182
C -3.847120 -2.864530 1.765180
H -4.034922 0.934021 -1.422700
H -3.297283 -0.359890 -2.383737
H 1.840421 -0.213895 -1.896207
H 2.213844 1.394543 -1.198938
H 2.177882 0.353826 1.147894
H 1.896092 -1.246284 0.429203
H -3.554970 2.413335 0.727021
H 1.442595 2.878924 0.573514
H -2.267327 2.557003 -2.319096
H -1.604889 1.254092 -3.314086
H -3.245186 1.837514 -3.604406
H 4.373261 -1.206112 1.908032
H 4.376358 0.583144 1.821088
H 3.608783 -1.519335 -1.784218
H 3.901851 -2.501455 -0.319741
H -2.911658 0.398964 2.007428
H -2.586261 -2.301553 -1.354462
H -2.425298 4.350130 1.805840
H 0.042315 4.572176 1.744102
H 6.426263 0.554418 0.374770
H 6.749322 -0.511632 1.806406
H 6.030956 -2.486500 -1.585560
H 5.979540 -0.680746 -1.747270
H -3.925521 -1.401314 3.349177
H -3.615134 -4.099920 0.007277
H -4.292197 -3.657311 2.362855


%chk=000216143-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000216143

0 1
O -0.480450 -1.215104 -1.925091
O 6.499875 -1.597159 0.045007
N 0.274707 0.643124 -0.680792
N 3.875271 -0.344266 0.020389
C -2.101403 0.273477 -0.663117
C -1.720085 1.551639 0.077682
C -0.710466 -0.226156 -1.178326
C -0.308368 1.711579 0.050124
C -3.038325 0.555984 -1.890249
C 1.707468 0.456260 -0.930440
C -2.724810 -0.826948 0.234168
C 2.425773 -0.196553 0.278005
C -2.515226 2.532535 0.688673
C 0.332531 2.815597 0.643227
C -2.476304 1.568051 -2.908976
C 4.678354 -0.434988 1.268753
C 4.193541 -1.492637 -0.872218
C -3.059968 -0.600422 1.592680
C -2.973382 -2.111780 -0.320952
C -1.891843 3.658698 1.289669
C -0.483740 3.790695 1.269773
C 6.176803 -0.461518 0.924614
C 5.697981 -1.510639 -1.186789
C -3.649341 -1.623483 2.371418
C -3.559394 -3.132260 0.457140
C -3.907375 -2.891897 1.807012
H -4.008986 0.910052 -1.492248
H -3.229608 -0.407462 -2.396433
H 1.788568 -0.189437 -1.821881
H 2.182456 1.427493 -1.158043
H 2.296573 0.452991 1.164314
H 1.930199 -1.170724 0.509992
H -3.606921 2.437177 0.698048
H 1.420719 2.932619 0.616033
H -2.268772 2.546540 -2.440566
H -1.541627 1.196378 -3.367217
H -3.204463 1.730064 -3.724231
H 4.425040 -1.352364 1.857134
H 4.462207 0.447497 1.900552
H 3.627991 -1.399953 -1.816991
H 3.903805 -2.462651 -0.395799
H -2.854157 0.371114 2.051155
H -2.671872 -2.320699 -1.352604
H -2.504125 4.428981 1.770216
H -0.013892 4.662673 1.738363
H 6.459469 0.490895 0.425777
H 6.791033 -0.604416 1.829048
H 5.969350 -2.400877 -1.777749
H 5.970764 -0.590773 -1.747873
H -3.902454 -1.427150 3.419695
H -3.738601 -4.117217 0.011319
H -4.364624 -3.683979 2.410705


