%chk=000214017.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000214017

0 1
O -3.604669 1.818085 -0.603868
O -5.781704 0.312310 -0.615853
N 4.568005 -1.228807 -0.122716
N 6.435880 -0.034699 1.125734
C 0.263717 0.148106 0.435957
C -0.964943 0.774685 0.098410
C 1.470757 0.909635 0.448341
C -2.190897 -0.019239 0.074387
C 2.792620 0.267338 0.776229
C -2.133776 -1.400924 0.406015
C 0.274032 -1.260239 0.771062
C 3.400803 -0.357118 -0.490894
C -0.954765 2.160964 -0.205067
C 1.440688 2.262140 0.142638
C -0.862625 -1.995975 0.758725
C -3.473190 0.495766 -0.265154
C 0.220373 2.887393 -0.181057
C -3.294904 -2.214238 0.401649
C -4.608528 -0.332556 -0.262252
C -4.533076 -1.693262 0.071226
C 5.056341 -2.063158 -1.260900
C 5.597823 -0.539686 0.501172
H 3.490659 1.009469 1.218313
H 2.674976 -0.507115 1.566683
H 1.229193 -1.715267 1.045432
H 3.670719 0.436724 -1.220431
H 2.647317 -1.011860 -0.987824
H -1.886770 2.674637 -0.460978
H 2.354687 2.854142 0.152466
H -0.852068 -3.055016 1.016483
H 0.212371 3.952134 -0.412973
H -3.203580 -3.267834 0.665006
H -5.425050 -2.314054 0.067590
H 5.913213 -2.677908 -0.931957
H 5.363323 -1.487407 -2.147618
H 4.250159 -2.759117 -1.551259
H -4.560311 2.040578 -0.810837
H -6.553501 -0.300626 -0.578676


%chk=000214017-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000214017

0 1
O -3.740547 1.868314 -0.543437
O -5.849040 0.351254 -0.580253
N 4.713581 -1.076587 -0.265981
N 6.523979 0.097584 1.096384
C 0.277218 0.164751 0.422662
C -0.982501 0.807847 0.100855
C 1.494181 0.936473 0.462725
C -2.212849 0.003342 0.062291
C 2.845253 0.290168 0.745785
C -2.138327 -1.416002 0.350937
C 0.293255 -1.254820 0.708255
C 3.414849 -0.394585 -0.521398
C -0.975216 2.214307 -0.165422
C 1.444127 2.315457 0.198239
C -0.861962 -2.006236 0.674570
C -3.514715 0.517341 -0.243270
C 0.215132 2.951068 -0.114385
C -3.300968 -2.241316 0.328917
C -4.647296 -0.328870 -0.256563
C -4.559821 -1.708020 0.026073
C 5.100904 -2.178834 -1.175101
C 5.673645 -0.443566 0.437178
H 3.556661 1.066227 1.082132
H 2.788463 -0.456111 1.558845
H 1.238699 -1.737792 0.973136
H 3.519099 0.357889 -1.332163
H 2.712608 -1.169652 -0.879109
H -1.913990 2.710713 -0.407238
H 2.368684 2.904066 0.238596
H -0.834520 -3.078344 0.902384
H 0.194953 4.027700 -0.315794
H -3.196919 -3.307385 0.555503
H -5.454530 -2.341820 0.008951
H 6.022401 -2.655675 -0.805162
H 5.278180 -1.819626 -2.209411
H 4.296501 -2.935519 -1.194194
H -4.714937 1.983190 -0.717332
H -6.630935 -0.248926 -0.574997


