%chk=000180842.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180842

0 1
Cl 7.660448 -0.815774 2.309237
S 5.048903 0.554175 -0.980013
F 4.940525 0.047851 1.589384
F 5.589676 -1.586150 0.430874
F 7.980232 -0.174463 -0.162649
F 0.846745 -2.106499 -1.750156
F -5.232059 -1.049763 2.455434
F -5.891842 1.040106 -1.688756
O 5.388551 1.944831 -0.785086
O 5.554374 -0.191405 -2.100325
O -1.449083 1.679059 0.611856
O -4.165307 1.907441 1.123373
N -0.835352 -0.264799 -0.512205
N -3.106580 0.129550 0.061361
C 3.352469 0.324951 -0.835041
C 5.733927 -0.249281 0.534926
C 2.763255 -0.831023 -1.364621
C 2.558558 1.297299 -0.216812
C 7.171924 0.136947 0.884904
C 0.557178 -0.028489 -0.604892
C 1.389709 -0.994761 -1.242022
C 1.179939 1.127149 -0.097955
C -1.768317 0.630880 0.109883
C -5.495901 0.044683 0.397781
C -4.241701 0.834800 0.596600
C -5.974389 -0.844104 1.373236
C -6.309731 0.217993 -0.732689
C -7.184754 -1.530062 1.249051
C -7.527328 -0.445066 -0.902290
C -7.958953 -1.316765 0.103352
H 3.371569 -1.590060 -1.876175
H 3.017940 2.214601 0.177403
H 7.299803 1.230190 1.102520
H 0.580857 1.907130 0.395653
H -1.180289 -1.136375 -0.922447
H -3.285481 -0.781078 -0.373781
H -7.525502 -2.210878 2.031065
H -8.134627 -0.281575 -1.794268
H -8.913387 -1.838764 -0.007911


%chk=000180842-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000180842

0 1
Cl 7.988819 -1.444018 2.023058
S 5.135049 0.827455 -0.948779
F 4.999968 -0.759997 1.371931
F 5.903146 -1.856731 -0.416844
F 8.155340 -0.141828 -0.331983
F 0.514093 -1.106849 -2.466588
F -6.551734 0.854636 2.418489
F -4.679973 -1.313780 -1.514021
O 5.594263 2.199000 -0.188168
O 5.535948 0.456516 -2.479329
O -1.522860 1.562319 1.235283
O -4.399539 1.904550 1.076291
N -0.890177 0.160823 -0.550909
N -3.111263 0.163164 0.159696
C 3.280942 0.619144 -0.762027
C 5.915750 -0.665226 0.305392
C 2.630905 -0.202547 -1.701608
C 2.612049 1.322788 0.252022
C 7.291855 -0.224522 0.795776
C 0.500913 0.369992 -0.555869
C 1.248327 -0.302412 -1.563583
C 1.210726 1.201894 0.353731
C -1.815614 0.718637 0.359201
C -5.544148 -0.138986 0.441620
C -4.323870 0.750854 0.600097
C -6.649614 -0.006424 1.328084
C -5.742087 -1.086630 -0.592886
C -7.847992 -0.726832 1.186469
C -6.912365 -1.828753 -0.790730
C -7.978464 -1.636151 0.115853
H 3.168737 -0.711165 -2.507170
H 3.166390 1.974537 0.933892
H 7.239099 0.756454 1.291145
H 0.653920 1.744452 1.118863
H -1.242864 -0.418458 -1.318758
H -3.191246 -0.713887 -0.363463
H -8.650807 -0.571034 1.911398
H -6.978443 -2.528903 -1.626951
H -8.907178 -2.199578 -0.010828


