%chk=000202381.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000202381

0 1
O 4.418961 -0.414387 0.248384
O 3.421663 2.352782 0.412522
O 2.399914 -2.432382 -0.307715
O -3.798592 1.719468 -0.664212
N -4.442739 -0.049562 0.618748
C 0.354700 0.577074 -0.253289
C 3.074525 -0.093018 0.082389
C 2.649749 1.250690 0.172693
C 2.115643 -1.082234 -0.232772
C 1.289833 1.583047 0.001255
C 0.762273 -0.758948 -0.386407
C -1.065655 0.944619 -0.410277
C -2.067765 0.290019 0.189485
C -3.474661 0.733859 -0.016263
C -5.885163 0.245479 0.452288
C 4.677102 -1.103506 1.507955
C 4.861183 2.191042 0.513559
C 3.508052 -2.803453 -1.173939
C -6.577673 -0.838432 -0.328894
C -7.806199 -1.264590 -0.047072
H 0.993429 2.628354 0.082995
H 0.049859 -1.547697 -0.617936
H -1.264097 1.814722 -1.055065
H -1.895617 -0.563829 0.843636
H -4.211379 -0.905701 1.106370
H -6.000866 1.222767 -0.090927
H -6.338317 0.389420 1.459683
H 4.102355 -2.035141 1.550252
H 4.426936 -0.450758 2.347678
H 5.752746 -1.295445 1.450916
H 5.106289 1.691374 1.454104
H 5.248153 1.625894 -0.341923
H 5.201816 3.233021 0.503126
H 3.649233 -3.860555 -0.924657
H 3.192088 -2.676227 -2.213452
H 4.404279 -2.210575 -0.957218
H -6.004216 -1.237433 -1.168602
H -8.314504 -2.023220 -0.625935
H -8.404337 -0.891739 0.771918


%chk=000202381-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000202381

0 1
O 4.536932 -0.426367 0.407793
O 3.637069 2.330657 0.435063
O 2.534057 -2.501056 0.251572
O -3.741384 1.957500 0.305594
N -4.530867 -0.236995 0.351658
C 0.378318 0.542196 0.286775
C 3.161597 -0.109530 0.324527
C 2.745166 1.251835 0.318609
C 2.169748 -1.134124 0.243366
C 1.367502 1.561439 0.303304
C 0.802236 -0.815991 0.239439
C -1.035337 0.941583 0.298279
C -2.131032 0.125574 0.308802
C -3.503596 0.705671 0.321484
C -5.952512 0.148057 0.357574
C 4.928455 -1.057985 1.694752
C 4.764598 2.387481 -0.522414
C 3.354470 -2.938974 -0.902699
C -6.714376 -0.485049 -0.789468
C -7.821678 -1.254854 -0.641505
H 1.079587 2.617712 0.323360
H 0.087230 -1.642511 0.193768
H -1.245943 2.021089 0.301603
H -2.033672 -0.968725 0.313618
H -4.300974 -1.232334 0.356648
H -5.956145 1.252057 0.276171
H -6.424212 -0.121628 1.323135
H 4.367050 -1.996466 1.849382
H 4.741562 -0.357517 2.528908
H 6.006208 -1.262250 1.604952
H 5.401311 1.491972 -0.436779
H 4.379034 2.484690 -1.555587
H 5.324099 3.293989 -0.246332
H 3.569813 -4.002498 -0.718955
H 2.777664 -2.828054 -1.840470
H 4.291452 -2.357751 -0.964590
H -6.316464 -0.276078 -1.793280
H -8.350820 -1.673856 -1.504357
H -8.237148 -1.478109 0.349701


