%chk=000179675.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000179675

0 1
O -0.359845 2.932927 -0.255471
O -2.677947 3.394457 -0.110897
O 4.855291 -1.087217 -0.242452
O 4.170949 1.718922 -0.408201
N -2.086419 -3.004415 0.289563
C -1.564443 -0.593926 0.054367
C -2.946559 -0.278575 0.156022
C -1.107808 -1.988502 0.092689
C -0.575955 0.433010 -0.073958
C -3.938995 -1.386295 0.362364
C -3.445516 -2.699590 -0.253282
C 0.834766 0.110434 -0.131959
C -1.082422 1.740051 -0.123966
C 1.227497 -1.249293 -0.059421
C 0.232890 -2.280386 0.038302
C -3.419466 1.037517 0.107875
C -2.455798 2.026880 -0.037660
C -1.672424 -4.406814 0.015687
C 1.830708 1.112903 -0.251136
C 2.604327 -1.588719 -0.100588
C -1.352318 4.006471 -0.249465
C 3.167812 0.769419 -0.292156
C 3.573472 -0.601929 -0.214947
C 5.945611 -0.135304 -0.352812
H -4.093950 -1.517335 1.459001
H -4.931801 -1.127003 -0.056025
H -4.132020 -3.529493 0.023839
H -3.443735 -2.631176 -1.364165
H 0.593759 -3.305796 0.072384
H -4.473555 1.283866 0.183784
H -0.809736 -4.664343 0.657320
H -1.393019 -4.590958 -1.034009
H -2.489309 -5.093448 0.290866
H 1.534830 2.163395 -0.309591
H 2.912611 -2.631419 -0.040963
H -1.315541 4.509498 -1.224399
H -1.175859 4.628511 0.637634
H 3.785265 2.629469 -0.449246
H 5.939392 0.543294 0.506647
H 5.861869 0.422963 -1.291218
H 6.819990 -0.794950 -0.346256


%chk=000179675-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000179675

0 1
O -0.398226 2.993505 -0.236762
O -2.748081 3.439817 -0.080182
O 4.908391 -1.097599 -0.284689
O 4.200328 1.790049 -0.420520
N -2.107439 -3.021969 0.143796
C -1.594887 -0.601846 0.030394
C -2.991188 -0.296436 0.151101
C -1.142919 -1.999865 0.053604
C -0.600584 0.454413 -0.089609
C -3.975907 -1.432692 0.370843
C -3.482372 -2.720941 -0.303827
C 0.820445 0.139585 -0.148686
C -1.128497 1.768360 -0.118893
C 1.215432 -1.243687 -0.088913
C 0.223620 -2.281828 -0.002971
C -3.456679 1.034697 0.116584
C -2.495526 2.043357 -0.024403
C -1.673479 -4.421119 0.101602
C 1.842612 1.125761 -0.258383
C 2.601128 -1.565705 -0.138159
C -1.417819 4.075446 -0.227925
C 3.202455 0.788134 -0.307408
C 3.604355 -0.588924 -0.245269
C 6.088889 -0.218627 -0.343140
H -4.086229 -1.623695 1.457469
H -4.973954 -1.161688 -0.019641
H -4.131875 -3.569996 -0.025190
H -3.528954 -2.607808 -1.411746
H 0.578997 -3.315558 -0.003778
H -4.520229 1.272503 0.201713
H -0.942478 -4.623496 0.905956
H -1.202735 -4.702668 -0.867321
H -2.546262 -5.075023 0.265535
H 1.558189 2.182130 -0.306004
H 2.924419 -2.610686 -0.093423
H -1.377620 4.613635 -1.191743
H -1.232906 4.735081 0.638179
H 3.766989 2.678598 -0.454359
H 6.137726 0.446286 0.535422
H 6.088342 0.393959 -1.259724
H 6.941128 -0.916358 -0.345432


