%chk=000221866.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000221866

0 1
O -6.049733 -2.554081 0.014162
O 6.049107 -2.556622 0.006178
N -2.833832 1.999465 0.354495
N 2.834327 1.996323 0.364935
C -1.405040 1.937103 0.272629
C 1.406019 1.935727 0.277507
C -0.693774 3.121281 0.574474
C 0.694793 3.120657 0.576786
C -0.696833 0.766115 -0.046146
C 0.697756 0.765393 -0.043714
C -3.634649 0.821814 0.176242
C 3.635181 0.819289 0.182006
C -4.668661 0.802418 -0.772271
C 4.668843 0.803238 -0.766937
C -3.445536 -0.280488 1.044169
C 3.445992 -0.286198 1.045786
C -5.309295 -1.389093 -0.011537
C 5.308998 -1.391387 -0.014816
C -5.518955 -0.305392 -0.867790
C 5.518735 -0.304454 -0.867006
C -4.273100 -1.387346 0.949565
C 4.273151 -1.392993 0.946647
C -7.144629 -2.675605 -0.923631
C 7.143326 -2.675144 -0.932810
H -3.233678 2.842327 -0.064370
H 3.236792 2.841844 -0.045940
H -1.233370 4.033526 0.823869
H 1.234275 4.032452 0.827951
H -1.227738 -0.148066 -0.311199
H 1.228591 -0.149316 -0.306980
H -4.822074 1.646953 -1.441300
H 4.822209 1.650301 -1.432797
H -2.652518 -0.245347 1.793457
H 2.653226 -0.253639 1.795471
H -6.318434 -0.305689 -1.601235
H 6.317967 -0.302233 -1.600718
H -4.149984 -2.250212 1.601915
H 4.149956 -2.258310 1.595728
H -7.538217 -3.671276 -0.680018
H -6.771806 -2.643342 -1.951184
H -7.894807 -1.902309 -0.735819
H 7.894040 -1.902980 -0.742499
H 6.769862 -2.638744 -1.959991
H 7.536519 -3.671962 -0.693265


%chk=000221866-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000221866

0 1
O -6.665574 -2.445221 0.161684
O 6.665432 -2.446288 0.159141
N -2.852120 1.751303 -0.054794
N 2.852589 1.750881 -0.055483
C -1.437577 1.686936 -0.035446
C 1.438049 1.686725 -0.035812
C -0.702752 2.820326 0.412408
C 0.703502 2.820229 0.412217
C -0.703894 0.560634 -0.500524
C 0.704082 0.560524 -0.500694
C -3.786689 0.687805 -0.031596
C 3.786996 0.687215 -0.032786
C -5.094515 0.909759 -0.538474
C 5.094557 0.908893 -0.540452
C -3.492336 -0.586639 0.536276
C 3.492749 -0.587119 0.535388
C -5.770855 -1.361013 0.065828
C 5.770854 -1.361935 0.063687
C -6.085580 -0.094958 -0.483883
C 6.085483 -0.095990 -0.486333
C -4.469442 -1.595176 0.575069
C 4.469695 -1.595826 0.573710
C -8.018848 -2.239060 -0.351994
C 8.018446 -2.240449 -0.355356
H -3.251428 2.689583 -0.098575
H 3.252030 2.689106 -0.099225
H -1.241206 3.701962 0.782365
H 1.242178 3.701794 0.782023
H -1.234405 -0.304186 -0.909412
H 1.234360 -0.304380 -0.909707
H -5.340651 1.880219 -0.987669
H 5.340590 1.879261 -0.989901
H -2.508515 -0.776754 0.974147
H 2.509150 -0.777002 0.973861
H -7.082190 0.119487 -0.881496
H 7.081898 0.118239 -0.884549
H -4.247715 -2.573175 1.013643
H 4.248059 -2.573741 1.012516
H -8.541764 -3.191737 -0.180914
H -8.010307 -2.008918 -1.436099
H -8.539669 -1.426122 0.192462
H 8.539747 -1.427552 0.188701
H 8.009309 -2.010431 -1.439481
H 8.541276 -3.193209 -0.184473


