%chk=000222253.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000222253

0 1
Cl -1.443111 -3.583135 0.727547
N 0.532246 0.889482 -0.358243
N -4.152583 0.680638 -0.086391
N -3.804461 1.973582 -0.392375
N -0.498979 -1.208888 0.157189
N -2.939280 -1.466436 0.334956
C -1.890349 0.739815 -0.206652
C 1.895112 0.430378 -0.248606
C -0.596902 0.132953 -0.130994
C -3.023021 -0.120671 0.038475
C 2.855907 1.284983 0.346461
C 4.576597 -0.380998 -0.126278
C 4.189940 0.865563 0.390172
C 2.275467 -0.819284 -0.762005
C -2.454729 2.032002 -0.469476
C 3.609189 -1.220677 -0.697841
C 2.474254 2.610929 0.921297
C -5.556966 0.279285 0.068892
C 6.003638 -0.815145 -0.048308
C -1.661521 -1.913283 0.370958
H 0.406967 1.888708 -0.522249
H 4.939623 1.513827 0.841005
H 1.527609 -1.486469 -1.199876
H -1.930191 2.944470 -0.701292
H 3.893840 -2.195121 -1.091403
H 2.207784 3.332771 0.137527
H 1.625322 2.524129 1.615540
H 3.295106 3.064239 1.496391
H -6.039598 0.855314 0.880698
H -6.120446 0.462379 -0.865352
H -5.614080 -0.800160 0.314421
H 6.702336 0.027933 -0.130797
H 6.204832 -1.311244 0.913727
H 6.268044 -1.529168 -0.839917


%chk=000222253-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000222253

0 1
Cl -1.719691 -3.766748 -0.615090
N 0.525116 0.726210 0.079541
N -4.173437 0.710393 0.028729
N -3.787941 2.041777 0.232711
N -0.645613 -1.335913 -0.240735
N -3.087146 -1.475995 -0.287951
C -1.915060 0.703304 0.051108
C 1.889520 0.308151 0.038672
C -0.651065 0.019628 -0.038881
C -3.077545 -0.120406 -0.083811
C 2.880530 1.331998 0.181263
C 4.659260 -0.387148 -0.021921
C 4.241477 0.957758 0.145439
C 2.283744 -1.042847 -0.135281
C -2.424314 2.028524 0.248818
C 3.653340 -1.373673 -0.164891
C 2.491724 2.791875 0.360367
C -5.586102 0.341677 -0.040676
C 6.132760 -0.753606 -0.024497
C -1.838780 -1.969637 -0.349749
H 0.395381 1.729496 0.222808
H 5.001526 1.742672 0.251287
H 1.514986 -1.807950 -0.249301
H -1.899562 2.971386 0.398416
H 3.940293 -2.423010 -0.302963
H 1.919976 3.184428 -0.505450
H 1.885025 2.958208 1.274475
H 3.390576 3.422026 0.459928
H -6.095123 0.604557 0.901202
H -6.076896 0.867881 -0.875885
H -5.641385 -0.745961 -0.202269
H 6.752432 0.056024 -0.449908
H 6.500655 -0.942329 1.003308
H 6.318934 -1.670050 -0.611612


