%chk=000282668.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000282668

0 1
O -4.493901 -2.292973 0.817021
O -4.575734 2.038391 -1.319386
O -5.971061 -0.345901 -0.394412
O 1.089284 3.877836 1.414186
O 3.237417 3.284845 1.438999
N 0.448190 -0.717342 -0.368821
C 2.448368 0.639739 0.222174
C 1.841265 -0.562961 -0.288031
C 4.647009 -0.347231 -0.154786
C 4.037536 -1.539964 -0.666106
C 1.546992 1.694270 0.644802
C -0.330682 0.274229 0.022481
C 3.844180 0.718913 0.278996
C 2.640571 -1.631875 -0.725336
C -1.807659 0.104069 -0.071644
C 0.195055 1.524325 0.548372
C 6.089380 -0.273010 -0.099746
C 4.887551 -2.621751 -1.109262
C -2.574596 1.113814 -0.647763
C -2.402575 -1.062245 0.433319
C -3.790716 -1.208067 0.352178
C -3.977980 0.966018 -0.717909
C -4.605273 -0.191343 -0.214500
C 6.856034 -1.315210 -0.526649
C 6.243724 -2.511271 -1.041246
C 2.098225 2.964583 1.186462
C -3.736150 -3.401191 1.368158
C -6.015923 2.018652 -1.507897
C -6.718235 -0.564720 0.834219
H 4.322941 1.626335 0.670218
H 2.156829 -2.531465 -1.113322
H -0.509180 2.303076 0.861073
H 6.539393 0.639436 0.292276
H 4.410056 -3.520918 -1.497318
H -2.126336 2.013894 -1.064683
H -1.772603 -1.843491 0.850573
H 7.943808 -1.269665 -0.489894
H 6.894577 -3.319657 -1.372690
H 1.437299 4.738404 1.777614
H -4.534021 -4.115995 1.606641
H -3.202872 -3.085117 2.268882
H -3.057281 -3.810007 0.613047
H -6.313503 1.122063 -2.065166
H -6.174979 2.933814 -2.089039
H -6.516082 2.055888 -0.536673
H -6.430948 -1.527417 1.275270
H -7.749826 -0.590922 0.468792
H -6.554164 0.258016 1.532127


%chk=000282668-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000282668

0 1
O -4.365455 -2.525399 0.062598
O -4.968547 2.316990 0.152461
O -6.082013 -0.299903 0.125478
O 1.148758 4.318068 0.170337
O 3.365985 3.670582 0.131090
N 0.382702 -0.639679 0.008205
C 2.455363 0.778589 0.024243
C 1.765660 -0.515094 -0.008723
C 4.622037 -0.405458 -0.056288
C 3.935581 -1.691874 -0.087688
C 1.596031 1.952674 0.081819
C -0.384139 0.472791 0.056314
C 3.868381 0.796562 -0.000793
C 2.521404 -1.710899 -0.062697
C -1.861288 0.290287 0.068763
C 0.210873 1.786882 0.096408
C 6.061720 -0.388251 -0.082610
C 4.720234 -2.899673 -0.143866
C -2.759778 1.384500 0.060698
C -2.385570 -1.029983 0.070273
C -3.774459 -1.250320 0.084425
C -4.155182 1.171260 0.081863
C -4.687712 -0.147876 0.119994
C 6.788417 -1.574443 -0.137057
C 6.110246 -2.843374 -0.168001
C 2.155000 3.336008 0.127727
C -3.465396 -3.680632 -0.023043
C -6.004589 2.467276 -0.893502
C -6.669983 -1.119212 1.210409
H 4.389274 1.757034 0.024053
H 1.970676 -2.656887 -0.086209
H -0.417008 2.676625 0.144664
H 6.576592 0.579217 -0.058712
H 4.201208 -3.865009 -0.167639
H -2.425938 2.424799 0.046999
H -1.665476 -1.851259 0.051241
H 7.883376 -1.549919 -0.156691
H 6.699187 -3.766149 -0.210920
H 1.585072 5.211196 0.202473
H -4.128698 -4.557460 -0.056128
H -2.803602 -3.740993 0.862011
H -2.851354 -3.637809 -0.942408
H -5.528203 2.556627 -1.889318
H -6.527070 3.403451 -0.644322
H -6.702630 1.614571 -0.879952
H -6.335396 -2.165785 1.130400
H -7.757925 -1.044650 1.061821
H -6.392962 -0.699097 2.195398


