%chk=000180809.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180809

0 1
Cl 1.170405 -3.065744 0.015683
Cl 8.183851 1.177458 -2.112677
S 5.472797 0.006759 1.042249
F 5.522154 1.528087 -1.087696
F 5.746281 -0.517538 -1.515505
F -5.394524 -1.617228 1.688926
F -5.008671 1.703062 -1.598853
F 7.967166 1.386806 0.446636
O -1.147963 1.577335 0.990023
O -3.937681 1.444309 1.655162
N -0.442429 -0.581614 0.464749
N -2.731039 0.010659 0.285967
C 0.960494 -0.402580 0.594895
C 3.744519 -0.143719 0.810392
C 1.816954 -1.515981 0.397243
C 1.540904 0.844512 0.904059
C 3.201798 -1.392784 0.501279
C 2.924136 0.972751 1.007478
C 6.102347 0.413970 -0.610949
C -5.137992 0.077801 0.088149
C -1.408541 0.456586 0.631141
C -3.928859 0.624374 0.779919
C -5.861854 -1.008077 0.604203
C -5.663537 0.677772 -1.066612
C 7.633017 0.526049 -0.550478
C -7.037614 -1.485704 0.021296
C -6.835985 0.236634 -1.686037
C -7.519938 -0.847696 -1.127022
H 0.903796 1.725196 1.068733
H 3.843094 -2.265464 0.340896
H 3.359099 1.949418 1.243589
H -0.772635 -1.536555 0.287632
H -2.831939 -0.763705 -0.377922
H 8.150246 -0.446678 -0.351316
H -7.574619 -2.331029 0.454133
H -7.215453 0.731278 -2.581667
H -8.442982 -1.202220 -1.593498


%chk=000180809-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180809

0 1
Cl 0.951118 -2.989754 0.632036
Cl 8.140381 0.557776 -2.444677
S 5.599744 0.055382 1.269020
F 5.573703 1.458416 -1.084143
F 5.500217 -0.798899 -1.339157
F -4.204398 -2.112755 0.081062
F -6.179585 2.289682 -0.510501
F 8.244589 1.044319 0.196487
O -1.173369 1.918724 0.792549
O -4.053943 1.842678 1.208913
N -0.452765 -0.325863 0.648330
N -2.693162 0.175772 0.256095
C 0.942763 -0.178511 0.788826
C 3.772261 -0.037481 1.042695
C 1.756553 -1.347756 0.795698
C 1.597035 1.078401 0.926284
C 3.150981 -1.300748 0.918892
C 2.998098 1.143156 1.049129
C 6.083116 0.245633 -0.547134
C -5.125320 0.132806 -0.137251
C -1.410596 0.705585 0.597256
C -3.930239 0.811958 0.510618
C -5.283774 -1.265518 -0.294987
C -6.243299 0.898699 -0.567885
C 7.613025 0.144903 -0.716419
C -6.431549 -1.892175 -0.795955
C -7.419656 0.330260 -1.085938
C -7.512653 -1.073680 -1.191662
H 0.989742 1.984838 0.941469
H 3.740729 -2.220130 0.911243
H 3.487782 2.115475 1.150791
H -0.780955 -1.297517 0.619452
H -2.732823 -0.744398 -0.191577
H 7.961806 -0.877526 -0.509148
H -6.468486 -2.981769 -0.869236
H -8.234358 0.987655 -1.399822
H -8.423913 -1.531137 -1.587150


