%chk=000180846.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180846

0 1
Cl 3.796716 -1.815627 -2.140855
Cl 0.814442 -2.208315 -2.050468
Cl 7.725846 -1.211542 2.016226
S 5.164849 0.886113 -0.892978
F 4.906682 -0.420329 1.450162
F 5.775199 -1.532448 -0.114022
F 7.996100 0.236178 -0.095844
F -5.178316 0.112942 2.581350
F -5.811522 0.018717 -2.063059
O 5.366283 2.218491 -0.282005
O -1.453492 1.897632 0.367938
O -4.267167 2.208336 0.015802
N -0.770210 -0.069669 -0.679717
N -3.040342 0.238990 -0.064853
C 3.426551 0.529012 -0.805455
C 0.626858 0.164535 -0.713431
C 5.770809 -0.300277 0.426360
C 2.852597 -0.603095 -1.373207
C 2.599803 1.481499 -0.190767
C 1.465250 -0.794771 -1.335563
C 1.221786 1.310570 -0.144104
C 7.147170 0.100399 0.959356
C -1.726454 0.814472 -0.083290
C -5.432801 0.121675 0.249275
C -4.243747 1.011128 0.070414
C -5.886631 -0.259432 1.521638
C -6.210525 -0.306289 -0.837906
C -7.040723 -1.021774 1.720091
C -7.370692 -1.069415 -0.690580
C -7.780603 -1.418058 0.601247
H 3.050622 2.380159 0.259048
H 0.596944 2.077093 0.337379
H 7.146907 1.069630 1.523734
H -1.111376 -0.912211 -1.156360
H -3.134768 -0.780483 -0.117351
H -7.363913 -1.295942 2.725817
H -7.951263 -1.380548 -1.560498
H -8.690673 -2.008649 0.737373


%chk=000180846-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180846

0 1
Cl 3.792637 -2.476977 -1.691093
Cl 0.558698 -2.692108 -1.415867
Cl 7.579782 0.202190 2.919423
S 5.316070 0.424476 -1.156806
F 4.767387 -0.062256 1.622397
F 6.117296 -1.636738 0.670887
F 8.126730 0.282797 0.283230
F -4.250210 -1.724978 1.223148
F -6.786028 1.821304 -0.930647
O 5.503405 2.062330 -0.929601
O -1.423213 2.063657 -0.043765
O -4.276191 2.256463 0.114604
N -0.758166 -0.133846 -0.600200
N -3.001647 0.290565 -0.148151
C 3.447804 0.189670 -0.941824
C 0.636709 0.023963 -0.708442
C 5.853368 -0.263544 0.750180
C 2.811815 -1.034643 -1.207051
C 2.707858 1.326999 -0.583856
C 1.413674 -1.115885 -1.086219
C 1.310565 1.254040 -0.464980
C 7.052480 0.580475 1.178198
C -1.699168 0.860780 -0.245015
C -5.437902 0.128947 0.177478
C -4.205432 1.009790 0.055611
C -5.474973 -1.148925 0.789157
C -6.706225 0.601924 -0.260585
C -6.635471 -1.903704 1.000919
C -7.904099 -0.111068 -0.083518
C -7.864758 -1.366501 0.559236
H 3.252688 2.264908 -0.417134
H 0.719571 2.129163 -0.192341
H 6.815627 1.653869 1.113865
H -1.100587 -1.072940 -0.829695
H -3.076558 -0.729946 -0.107044
H -6.568913 -2.875673 1.495754
H -8.838829 0.320221 -0.450432
H -8.789599 -1.930104 0.711075


