%chk=000203194.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000203194

0 1
O 7.915767 0.984573 1.071643
O -3.130459 -1.091401 0.482737
O 3.300018 -2.777235 -0.692374
O -0.763874 2.309282 0.258625
O -3.121038 1.145752 0.781528
N 5.868882 -0.342386 -0.408166
N -6.788262 -0.834150 -0.140189
N 3.067491 -0.476365 -0.630487
C 7.122419 0.133037 -1.082950
C 6.160310 -0.720229 1.015843
C 7.665255 1.341304 -0.301162
C 6.730604 0.508849 1.740595
C 5.276686 -1.497508 -1.147278
C 3.798876 -1.675619 -0.786772
C -5.336552 -0.655333 -0.453953
C -7.573564 -1.257079 -1.346203
C -7.357124 0.410540 0.479919
C -4.557557 -1.127677 0.781615
C 1.681698 -0.364855 -0.339507
C -7.260944 -2.713933 -1.691518
C -8.630646 0.068910 1.254746
C -1.069653 -0.029951 0.222077
C 1.164412 0.934856 -0.176242
C 0.837160 -1.489798 -0.225112
C -0.203663 1.080261 0.099813
C -0.510784 -1.313449 0.050165
C -2.495717 0.143659 0.523255
H 7.904751 -0.654482 -1.145429
H 6.873584 0.437677 -2.121667
H 6.872262 -1.570239 1.100468
H 5.211568 -1.039916 1.499052
H 6.968478 2.197315 -0.331744
H 8.666180 1.648371 -0.653920
H 7.110612 0.258938 2.747596
H 5.995402 1.330182 1.801830
H 5.339748 -1.320294 -2.246866
H 5.792066 -2.470545 -0.966176
H -5.053718 0.391884 -0.701337
H -5.038551 -1.269173 -1.331205
H -8.655951 -1.166187 -1.099506
H -7.393030 -0.605604 -2.228146
H -6.602455 0.828795 1.184850
H -7.562705 1.207889 -0.266238
H -4.758131 -0.511759 1.674199
H -4.713667 -2.198298 1.002425
H 3.603788 0.405139 -0.663942
H -7.930689 -3.085533 -2.472978
H -7.379263 -3.357444 -0.809001
H -6.230158 -2.841657 -2.041392
H -9.450578 -0.224449 0.590019
H -8.457251 -0.773382 1.938505
H -8.967606 0.923027 1.850613
H 1.799089 1.808658 -0.260704
H 1.244435 -2.499200 -0.351099
H -1.170234 -2.186497 0.139899
H -0.104217 3.046426 0.167344


%chk=000203194-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000203194

0 1
O 7.585221 1.489761 0.991197
O -3.095485 -1.346274 0.427243
O 3.462723 -3.072498 -1.119237
O -0.488052 2.041585 0.889018
O -3.000034 0.905560 1.034566
N 5.834535 -0.336701 -0.434443
N -6.764707 -0.741535 -0.289887
N 3.204385 -0.802451 -0.487946
C 6.918652 0.404814 -1.140966
C 6.206030 -0.573111 0.993390
C 7.204868 1.727090 -0.410212
C 6.508989 0.765523 1.685026
C 5.418686 -1.584863 -1.119166
C 3.923981 -1.916139 -0.897471
C -5.317227 -0.853965 -0.590445
C -7.646435 -1.172872 -1.405263
C -7.128949 0.588684 0.274336
C -4.562648 -1.311095 0.673022
C 1.822410 -0.679802 -0.222337
C -7.684870 -2.702831 -1.582187
C -8.357452 0.530440 1.201787
C -0.958169 -0.289403 0.352319
C 1.342481 0.586659 0.195782
C 0.911227 -1.764015 -0.357258
C -0.027458 0.787984 0.480190
C -0.444711 -1.547435 -0.070838
C -2.407689 -0.128381 0.642390
H 7.855876 -0.198272 -1.186456
H 6.592333 0.616059 -2.176535
H 7.100531 -1.235816 1.062556
H 5.365827 -1.078979 1.505177
H 6.305119 2.379625 -0.450228
H 8.060593 2.252273 -0.864496
H 6.873211 0.605768 2.712621
H 5.590302 1.392574 1.712882
H 5.563739 -1.466191 -2.210087
H 6.004840 -2.476889 -0.810475
H -4.884178 0.108231 -0.948652
H -5.160341 -1.599831 -1.389434
H -8.669118 -0.820812 -1.177217
H -7.353405 -0.687332 -2.370844
H -6.261759 0.960080 0.850906
H -7.303534 1.336529 -0.539934
H -4.770309 -0.633305 1.518954
H -4.829886 -2.345327 0.938186
H 3.833708 0.014343 -0.364324
H -8.367183 -2.980585 -2.407493
H -8.037209 -3.182896 -0.652635
H -6.687346 -3.114996 -1.821215
H -9.261521 0.182859 0.669012
H -8.168514 -0.164980 2.038128
H -8.576711 1.532750 1.615213
H 2.043564 1.427055 0.297512
H 1.277499 -2.739914 -0.678584
H -1.155267 -2.371214 -0.169595
H 0.262329 2.688158 0.930545


