%chk=000191253.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000191253

0 1
O 3.752641 -0.139873 -1.443108
O 4.779980 2.462174 -1.138796
N 2.310266 -2.143713 0.154122
N 4.258056 0.945599 0.541332
N -2.788480 0.286763 0.231873
N 4.114211 3.130593 2.289804
N -3.750662 -0.153896 -0.445104
C 3.517131 -1.420092 0.626721
C 4.668311 -2.434515 0.450235
C 4.234474 -3.348499 -0.710418
C 2.709893 -3.178553 -0.855266
C 1.057411 -1.503432 0.073159
C 3.828366 -0.170786 -0.243812
C 0.002233 -2.098916 -0.664161
C 0.800462 -0.328644 0.823837
C -1.267919 -1.540490 -0.639271
C -0.474585 0.222199 0.844958
C -1.523241 -0.376872 0.116313
C 4.661230 2.213443 0.035206
C 5.009830 3.254890 1.109936
C -5.024209 0.515387 -0.304322
C -5.893221 0.378865 -1.404154
C -5.438619 1.203540 0.849918
C -7.170033 0.938264 -1.340981
C -6.722032 1.751672 0.898922
C -7.586588 1.622140 -0.192846
H 3.368287 -1.149152 1.701237
H 5.633202 -1.941568 0.242483
H 4.803782 -3.018150 1.379538
H 4.744905 -3.054801 -1.647374
H 4.507038 -4.398955 -0.516128
H 2.440630 -2.869738 -1.888450
H 2.165798 -4.116493 -0.616584
H 0.172967 -2.996640 -1.252084
H 1.588555 0.152460 1.394255
H 4.200304 0.869487 1.569113
H -2.080367 -2.000768 -1.208719
H -0.671986 1.126689 1.425279
H 6.067491 3.084068 1.421351
H 4.991253 4.257707 0.621851
H 3.199913 3.527332 2.081224
H 4.494999 3.653061 3.074741
H -5.563656 -0.159261 -2.293243
H -4.759193 1.306098 1.696382
H -7.845603 0.839857 -2.189547
H -7.048567 2.283546 1.791332
H -8.585159 2.052971 -0.150056


%chk=000191253-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000191253

0 1
O 4.091265 0.014250 -1.564154
O 5.531585 2.590915 -0.946387
N 2.279309 -1.815764 -0.182409
N 4.460631 1.051776 0.524001
N -2.935577 0.392044 0.067740
N 4.768772 2.552768 2.673185
N -3.933316 -0.287304 -0.455138
C 3.434066 -1.197874 0.482332
C 4.484242 -2.348512 0.507406
C 4.174798 -3.132701 -0.792639
C 2.633841 -3.063061 -0.903439
C 0.999694 -1.278369 -0.154497
C 4.005894 0.014321 -0.313721
C -0.103297 -1.990009 -0.737977
C 0.732434 -0.016076 0.468449
C -1.401382 -1.475407 -0.686163
C -0.572447 0.491246 0.516032
C -1.663577 -0.223498 -0.050967
C 5.143064 2.234586 0.190165
C 5.403431 3.103161 1.452233
C -5.210252 0.350714 -0.326493
C -6.305452 -0.369657 -0.874247
C -5.436688 1.614898 0.291623
C -7.611035 0.160607 -0.807692
C -6.742282 2.137016 0.353599
C -7.834726 1.415679 -0.193718
H 3.168230 -0.877832 1.509977
H 5.521384 -1.975214 0.547758
H 4.306268 -2.978354 1.398240
H 4.631783 -2.620362 -1.655317
H 4.543708 -4.171112 -0.758470
H 2.301096 -3.012888 -1.956632
H 2.145891 -3.939018 -0.426687
H 0.071504 -2.953354 -1.226512
H 1.549611 0.575331 0.892178
H 4.290959 1.030754 1.554074
H -2.242194 -2.019865 -1.127235
H -0.782803 1.458019 0.986065
H 6.500446 3.163041 1.572880
H 5.061598 4.126933 1.210088
H 3.921270 3.045484 2.969624
H 5.407399 2.400338 3.457978
H -6.102926 -1.337952 -1.344341
H -4.580175 2.155391 0.706065
H -8.450957 -0.400302 -1.232525
H -6.917786 3.109866 0.827719
H -8.847804 1.830344 -0.141352


