%chk=000197752.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000197752

0 1
O 0.682598 1.735299 -0.973353
O -3.102839 -0.922631 0.739312
O -4.160074 0.929272 -2.057756
N 1.308965 -1.460658 0.340836
N 1.700059 -0.096289 0.096022
N -1.819093 0.036397 -0.934157
N -5.415137 0.117605 -0.309584
C -0.118586 -1.511022 0.119246
C -0.544415 -0.330265 -0.447452
C 0.596220 0.615842 -0.536332
C 3.082201 0.161508 -0.236134
C 1.792289 -1.959774 1.661306
C -0.885900 -2.733575 0.398811
C 3.504665 1.504789 -0.201861
C 3.985804 -0.867758 -0.548565
C 4.841824 1.802416 -0.463367
C 5.322205 -0.546268 -0.799231
C -2.996500 -0.252954 -0.277911
C 5.754788 0.781940 -0.754091
C -4.245513 0.335522 -0.995086
C -6.705278 0.611487 -0.827674
H 2.881194 -1.790404 1.750273
H 1.613878 -3.047103 1.707977
H 1.307194 -1.474720 2.524805
H -0.313970 -3.527530 0.893978
H -1.303595 -3.158419 -0.530959
H -1.769084 -2.496272 1.039006
H -1.824638 0.665191 -1.752700
H 2.787515 2.302533 0.007357
H 3.652210 -1.901964 -0.615726
H 5.174671 2.840307 -0.441501
H 6.028686 -1.340246 -1.039399
H 6.796686 1.023965 -0.951762
H -5.423321 -0.390834 0.574946
H -7.399539 -0.227084 -1.006137
H -6.563463 1.146459 -1.789532
H -7.166110 1.316039 -0.114404


%chk=000197752-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000197752

0 1
O 0.463456 1.766635 -0.716120
O -3.414303 -1.627678 -0.069684
O -3.930755 1.783649 -1.117319
N 1.287822 -1.472654 0.505650
N 1.665926 -0.149609 0.108876
N -1.887245 0.168752 -0.343782
N -5.447078 0.001699 -0.848758
C -0.129166 -1.541892 0.478856
C -0.619894 -0.333847 -0.010231
C 0.501243 0.587677 -0.249038
C 3.004848 0.144601 -0.295654
C 2.039226 -2.042453 1.651086
C -0.799431 -2.788250 0.980574
C 3.461559 1.484900 -0.222140
C 3.856310 -0.878220 -0.787656
C 4.774930 1.790305 -0.636121
C 5.173839 -0.558619 -1.178665
C -3.120613 -0.420506 -0.365378
C 5.640545 0.774161 -1.104467
C -4.207372 0.577981 -0.818282
C -6.654926 0.727395 -1.243320
H 3.119149 -1.979743 1.451053
H 1.762686 -3.102328 1.754306
H 1.814433 -1.507688 2.594990
H -0.727552 -2.872056 2.082740
H -0.334317 -3.689944 0.541392
H -1.865187 -2.761763 0.707468
H -1.882730 1.158509 -0.658246
H 2.785168 2.266536 0.131126
H 3.474284 -1.898751 -0.895681
H 5.123169 2.827616 -0.586577
H 5.829090 -1.350086 -1.558915
H 6.661559 1.018884 -1.415865
H -5.479407 -0.987285 -0.575442
H -7.123667 0.266263 -2.131975
H -6.365533 1.762020 -1.488588
H -7.393468 0.746588 -0.421012


