%chk=000286559.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000286559

0 1
O 0.112794 -0.653307 2.914259
O -0.752906 1.441384 -1.030282
O 0.881443 -1.314947 -1.428113
O -1.824115 0.499179 2.897284
O -5.892063 3.328443 0.761420
O -4.920743 -2.195749 -2.642693
O -6.685813 1.738127 1.987111
O -5.926937 -2.803407 -0.831173
O 4.662486 3.362963 -0.725461
O 5.808912 -2.635893 1.748901
O 6.026293 2.437337 -2.121353
O 7.148310 -2.353135 0.080316
N -0.935949 0.082143 2.211983
N -5.946201 2.166788 1.121539
N -5.225905 -2.044527 -1.474644
N 5.173018 2.393638 -1.255865
N 6.125523 -2.113933 0.695574
N 1.051038 -1.024756 1.998027
C -2.798322 0.536730 -0.185361
C 2.901938 -0.502438 -0.421881
C -3.298800 -0.614300 -0.818700
C -3.653703 1.479793 0.418735
C 3.811282 -1.459659 0.067044
C 3.332525 0.762501 -0.866382
C -5.582011 0.033083 -0.125655
C -5.038343 1.203644 0.455226
C -4.695579 -0.845485 -0.784421
C 5.664558 0.124629 -0.333501
C 4.714439 1.057032 -0.807920
C 5.185735 -1.123617 0.123698
C -1.329635 0.785521 -0.200337
C 1.456351 -0.844339 -0.482422
C -0.571886 0.133820 0.908017
C 0.692737 -0.575014 0.797578
C -2.397173 -1.576529 -1.494953
C -3.082944 2.701035 1.038387
C 3.340507 -2.792785 0.515682
C 2.375943 1.754365 -1.406207
C -7.040292 -0.224513 -0.084294
C 7.099764 0.486299 -0.278503
H -1.329348 -1.295159 -1.518597
H -2.680343 -1.713546 -2.561703
H -2.437162 -2.582380 -1.044339
H -3.760252 3.578052 0.990146
H -2.154333 3.049630 0.558800
H -2.859632 2.536250 2.109878
H 3.364608 -2.857006 1.626779
H 2.319419 -3.053814 0.207253
H 3.978825 -3.622107 0.164481
H 2.504799 2.758455 -0.952803
H 2.500657 1.893275 -2.495923
H 1.306527 1.509728 -1.266515
H -7.507062 0.074963 0.876704
H -7.315686 -1.291490 -0.189601
H -7.576241 0.321752 -0.879208
H 7.436368 1.041026 -1.178871
H 7.330415 1.125195 0.590734
H 7.788865 -0.378841 -0.227773


%chk=000286559-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000286559

0 1
O 0.389468 -0.282978 3.042743
O -0.882353 1.487159 -1.025386
O 0.879951 -0.997491 -1.379399
O -2.100945 0.346062 2.853407
O -6.135814 3.202453 -1.257356
O -5.095634 -3.266139 -0.988373
O -7.021614 2.523101 0.733241
O -5.992010 -2.779178 1.052772
O 5.126772 3.092134 1.164332
O 6.086724 -3.378204 -0.044322
O 6.349990 2.933594 -0.754864
O 7.002843 -2.280384 -1.822325
N -1.055006 0.130528 2.202635
N -6.189444 2.407514 -0.244234
N -5.325125 -2.466493 -0.003481
N 5.512349 2.463759 0.105709
N 6.176294 -2.365723 -0.836952
N 1.320705 -0.429643 2.059044
C -2.939255 0.474285 -0.192354
C 3.018771 -0.335293 -0.394369
C -3.399735 -0.877546 -0.144560
C -3.841632 1.581388 -0.252504
C 3.868820 -1.455693 -0.635358
C 3.540036 0.969671 -0.145426
C -5.761005 -0.031796 -0.100762
C -5.224996 1.275210 -0.200463
C -4.801323 -1.073870 -0.090906
C 5.863681 0.048562 -0.361773
C 4.950295 1.110087 -0.139083
C 5.266165 -1.212395 -0.599341
C -1.463709 0.744117 -0.189348
C 1.525353 -0.519978 -0.403756
C -0.628771 0.161005 0.922051
C 0.773251 -0.189137 0.848521
C -2.441699 -2.056519 -0.177254
C -3.371951 3.021058 -0.327524
C 3.337160 -2.853483 -0.887555
C 2.625902 2.170527 0.029653
C -7.250287 -0.300200 -0.049009
C 7.365610 0.240279 -0.318713
H -1.470250 -1.787658 -0.620773
H -2.858945 -2.877427 -0.781091
H -2.266229 -2.455283 0.840767
H -3.420089 3.381221 -1.370120
H -2.333548 3.138969 0.011531
H -4.012857 3.687349 0.273608
H 3.527068 -3.495833 -0.009581
H 2.263807 -2.852072 -1.112600
H 3.853547 -3.327314 -1.741162
H 2.479863 2.394774 1.101484
H 3.059888 3.078012 -0.422191
H 1.642252 2.010237 -0.440252
H -7.601743 -0.276360 0.997438
H -7.502712 -1.288668 -0.462732
H -7.820522 0.461725 -0.602965
H 7.742891 0.508998 -1.320703
H 7.652495 1.052158 0.367399
H 7.883951 -0.679072 -0.005319


