%chk=000217570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000217570

0 1
Cl 7.625159 -1.038342 1.563623
O -3.475946 -2.759646 -0.750960
N 0.632246 0.135355 -1.250679
N 4.281117 0.278834 -0.251821
N -2.113789 2.267854 1.198137
C 2.072046 0.467604 -1.302309
C 2.831579 -0.010188 -0.043091
C -0.236495 0.823657 -0.389017
C -1.541149 0.242021 -0.100775
C -2.436538 1.008629 0.693962
C -1.951669 -1.034208 -0.567496
C 0.064026 2.073700 0.134657
C 5.135639 -0.340949 0.806883
C -3.735277 0.487574 1.010233
C -3.212047 -1.504976 -0.238638
C -4.122003 -0.747159 0.555632
C -0.911226 2.759558 0.914963
C 6.582811 -0.283266 0.315251
C -4.776369 -3.339717 -0.494048
H 2.503229 -0.013945 -2.212271
H 2.197715 1.564519 -1.447020
H 2.407360 0.466147 0.867563
H 2.696937 -1.107328 0.084088
H 0.426660 -0.853218 -1.407670
H 4.431158 1.294789 -0.261661
H -1.298599 -1.644430 -1.187199
H 1.017276 2.555800 -0.049899
H 4.833003 -1.403765 0.953246
H 5.040286 0.149802 1.800691
H -4.398866 1.105714 1.620766
H -5.105353 -1.143083 0.794746
H -0.675054 3.752812 1.318297
H 6.716951 -0.845140 -0.629893
H 6.940501 0.750208 0.158425
H -4.697223 -4.301773 -1.018228
H -5.564347 -2.721047 -0.932780
H -4.921549 -3.491297 0.579191


%chk=000217570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000217570

0 1
Cl 8.195597 -0.481952 1.226839
O -3.746222 -2.769994 -0.844338
N 0.697481 -0.203401 -0.842009
N 4.390752 0.339711 -0.164992
N -2.174650 2.256183 1.192286
C 2.096630 0.161137 -1.077382
C 3.019028 -0.118338 0.137581
C -0.224318 0.590465 -0.173317
C -1.599966 0.131549 -0.012617
C -2.523269 1.008020 0.679884
C -2.069191 -1.122277 -0.500797
C 0.104322 1.855337 0.360029
C 5.451815 -0.080579 0.774716
C -3.874969 0.577542 0.849945
C -3.404181 -1.512442 -0.317060
C -4.321719 -0.654717 0.367505
C -0.892891 2.632594 1.015946
C 6.799057 0.003899 0.046538
C -5.131229 -3.221252 -0.690004
H 2.477749 -0.408049 -1.943286
H 2.155730 1.233316 -1.354221
H 2.579538 0.348782 1.050272
H 3.050742 -1.208894 0.320024
H 0.389670 -1.112321 -1.181055
H 4.424514 1.350129 -0.356602
H -1.425097 -1.829668 -1.035270
H 1.117464 2.259107 0.285703
H 5.265018 -1.129789 1.066114
H 5.493000 0.516140 1.714455
H -4.548778 1.259943 1.377045
H -5.364175 -0.950990 0.516155
H -0.620250 3.615337 1.421158
H 6.847777 -0.695656 -0.799334
H 7.038874 1.026983 -0.283557
H -5.165563 -4.207524 -1.175731
H -5.838927 -2.534180 -1.193279
H -5.407164 -3.323050 0.377557


