%chk=000207596.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000207596

0 1
N 1.207488 -0.653852 -0.435941
N -0.835495 0.567906 -0.214329
N -0.723860 -1.863288 0.138155
N -2.924620 1.678146 0.079911
N -2.888151 -0.702018 0.223984
N -2.716696 -3.017316 0.675653
C 2.017456 0.595015 -0.531134
C 2.379700 1.139748 0.866761
C 3.277824 0.297749 -1.369946
C 3.404469 0.264179 1.595095
C 4.310839 -0.555778 -0.623776
C 4.661650 0.048716 0.742229
C -0.142976 -0.629931 -0.145985
C -2.205855 0.486702 -0.003417
C -2.092470 -1.830880 0.324271
C -4.405407 1.616168 0.003775
C -2.321088 2.909739 -0.486476
H 1.393998 1.364923 -1.066190
H 1.458309 1.237914 1.475506
H 2.775344 2.167307 0.754410
H 3.735115 1.264466 -1.659359
H 2.991900 -0.197679 -2.318454
H 2.950428 -0.711920 1.853938
H 3.678042 0.733184 2.559246
H 5.225857 -0.652339 -1.238955
H 3.929071 -1.586311 -0.491571
H 5.187677 1.012466 0.601271
H 5.370995 -0.611361 1.275435
H 1.712519 -1.519998 -0.238927
H -4.831378 2.557770 0.383483
H -4.780996 0.791880 0.643687
H -4.772080 1.436806 -1.019511
H -1.254213 2.976501 -0.193351
H -2.838197 3.791820 -0.077437
H -2.368136 2.939042 -1.586876
H -3.723556 -3.063461 0.645242
H -2.208205 -3.882115 0.570382


%chk=000207596-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000207596

0 1
N 1.206207 -0.687066 -0.407842
N -0.813030 0.515040 -0.246412
N -0.728106 -1.915306 0.022924
N -2.898678 1.607919 -0.087981
N -2.864048 -0.735518 0.185200
N -2.726757 -3.056569 0.442960
C 2.018970 0.519234 -0.664562
C 2.324797 1.299930 0.645532
C 3.333068 0.112846 -1.378059
C 3.279516 0.518348 1.576752
C 4.305676 -0.656741 -0.447822
C 4.592493 0.141433 0.847324
C -0.150288 -0.683112 -0.202729
C -2.174004 0.431891 -0.049768
C -2.083583 -1.863183 0.209649
C -4.353537 1.616623 0.102185
C -2.250318 2.901221 -0.331356
H 1.420062 1.172727 -1.326116
H 1.369818 1.527177 1.152882
H 2.789239 2.269281 0.368288
H 3.832047 1.040698 -1.720880
H 3.099632 -0.482236 -2.282297
H 2.772947 -0.404625 1.925073
H 3.502424 1.118410 2.479975
H 5.248495 -0.864907 -0.989401
H 3.882320 -1.647638 -0.178347
H 5.141744 1.069945 0.585192
H 5.252164 -0.443289 1.517447
H 1.650290 -1.604937 -0.359936
H -4.627240 2.244595 0.973352
H -4.690167 0.584436 0.273521
H -4.860326 2.026395 -0.794373
H -1.168572 2.736706 -0.435923
H -2.440031 3.594024 0.512523
H -2.643707 3.366140 -1.257513
H -3.732743 -3.056524 0.584309
H -2.181472 -3.913465 0.467027


