%chk=000207149.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207149

0 1
O -0.209276 -0.905773 -0.257931
O -2.313500 2.628033 0.224715
N 3.798607 -1.147140 0.229506
C 1.852238 0.239371 -0.381554
C 0.450298 0.323731 -0.231570
C 2.530917 -1.091825 -0.574885
C -0.222215 1.541874 -0.071620
C -2.345924 0.261801 0.053249
C -1.695120 1.592097 0.083980
C -1.590423 -0.906477 -0.112673
C 2.571598 1.436215 -0.364932
C 0.539815 2.726977 -0.060378
C 1.921143 2.671613 -0.204755
C -3.742160 0.131211 0.189098
C -2.169380 -2.187851 -0.147846
C 4.628979 -2.310866 -0.203817
C 3.497992 -1.239954 1.689208
C -4.337194 -1.125725 0.157561
C -3.550348 -2.280156 -0.010748
H 1.827109 -1.923917 -0.340198
H 2.794539 -1.198679 -1.653873
H 3.661389 1.399926 -0.469208
H 0.018614 3.681377 0.064062
H 2.509100 3.588302 -0.194457
H -4.340260 1.039331 0.318954
H -1.541800 -3.065760 -0.279468
H 4.905894 -2.182255 -1.262448
H 4.151484 -3.294158 -0.084595
H 5.567506 -2.312654 0.374483
H 2.957092 -2.147095 1.994933
H 2.897161 -0.365316 1.989589
H 4.444118 -1.192469 2.251234
H -5.416422 -1.221615 0.262885
H -4.031172 -3.259874 -0.033902


%chk=000207149-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207149

0 1
O -0.320944 -0.963039 -0.173052
O -2.394999 2.686053 0.081638
N 3.895839 -1.176666 0.179886
C 1.802682 0.151976 -0.166934
C 0.388230 0.256540 -0.124723
C 2.490363 -1.206229 -0.283279
C -0.282265 1.508302 -0.043792
C -2.461378 0.270579 -0.037245
C -1.764757 1.581801 0.006320
C -1.724754 -0.941215 -0.124238
C 2.541042 1.352631 -0.137338
C 0.500009 2.693627 -0.013014
C 1.900387 2.617393 -0.061131
C -3.879847 0.194405 0.005594
C -2.366352 -2.198538 -0.169217
C 4.705217 -2.271365 -0.390377
C 4.005017 -1.112054 1.652793
C -4.533594 -1.047307 -0.037375
C -3.771586 -2.245583 -0.125337
H 1.882605 -1.974737 0.252590
H 2.490400 -1.508336 -1.349782
H 3.632411 1.264738 -0.172350
H -0.032298 3.648342 0.047984
H 2.503236 3.531089 -0.040180
H -4.431105 1.138213 0.072493
H -1.759646 -3.106132 -0.237367
H 4.668899 -2.229463 -1.493603
H 4.369797 -3.290150 -0.069572
H 5.758243 -2.150336 -0.078836
H 3.609500 -2.028441 2.159282
H 3.442573 -0.242687 2.034519
H 5.063859 -0.988792 1.941807
H -5.626592 -1.097041 -0.004014
H -4.279793 -3.215278 -0.159551


