%chk=000180861.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000180861

0 1
Cl 7.507690 2.040534 1.674274
S 5.149954 -0.472184 -1.084508
F 4.764890 1.521775 0.699583
F 5.663449 -0.216741 1.475059
F 7.938926 0.245255 -0.118846
F -5.460624 -1.887507 -1.747479
F -5.014662 0.919245 1.981293
O 5.492582 0.400871 -2.233767
O -1.368670 1.473552 -1.816543
O -3.011971 -1.460684 0.585369
N -0.793643 -0.372612 -0.493995
N -3.074051 0.377333 -0.789585
C 2.762590 -1.428996 -0.106659
C 1.356836 -1.396618 0.028745
C 3.400279 -0.444597 -0.874429
C 0.627341 -0.379740 -0.643435
C 2.670473 0.546255 -1.536247
C 1.285817 0.583053 -1.429698
C 3.542613 -2.504423 0.577478
C 0.673398 -2.424320 0.875661
C 5.667418 0.575579 0.386633
C 7.034711 1.223159 0.160748
C -1.661498 0.549041 -1.084639
C -5.155216 -0.491785 0.112812
C -3.671980 -0.607654 0.022806
C -6.007977 -1.174940 -0.769161
C -5.781264 0.251796 1.126259
C -7.400276 -1.128831 -0.669218
C -7.168770 0.328182 1.266455
C -7.971596 -0.372520 0.359881
H 3.189790 1.294823 -2.148810
H 0.718535 1.361594 -1.953475
H 3.044944 -3.484170 0.498881
H 3.644407 -2.286451 1.653829
H 4.555264 -2.657995 0.183669
H 1.057664 -2.406878 1.906965
H -0.418942 -2.291799 0.956542
H 0.829806 -3.437701 0.476210
H -1.193906 -1.126717 0.121358
H 7.050611 1.955866 -0.688260
H -3.671643 1.082969 -1.249841
H -8.030519 -1.673709 -1.374172
H -7.618887 0.916957 2.067629
H -9.059893 -0.327966 0.456529


%chk=000180861-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000180861

0 1
Cl 7.595154 2.637806 1.130315
S 5.264525 -0.756696 -1.070807
F 4.742465 1.583797 0.501326
F 5.840834 -0.062168 1.642187
F 8.081694 0.254079 -0.023860
F -5.486703 0.031452 -2.260398
F -4.940347 -0.896266 2.479407
O 5.578905 0.161882 -2.426906
O -1.363387 1.241111 -2.304738
O -2.915765 -1.312446 0.673747
N -0.791596 -0.351349 -0.635341
N -3.044944 0.292913 -1.016197
C 2.709179 -1.423373 0.108046
C 1.290816 -1.302865 0.170456
C 3.387494 -0.639121 -0.857956
C 0.621550 -0.422621 -0.743869
C 2.739664 0.218962 -1.759256
C 1.342134 0.331243 -1.707980
C 3.457771 -2.352507 1.052324
C 0.474404 -2.081033 1.190469
C 5.763423 0.620334 0.411251
C 7.074585 1.269202 -0.019948
C -1.650437 0.434835 -1.378509
C -5.111951 -0.470823 0.090640
C -3.616298 -0.538648 -0.057210
C -6.016171 -0.235404 -0.977112
C -5.733572 -0.709089 1.347993
C -7.411306 -0.254835 -0.855537
C -7.126117 -0.734544 1.530253
C -7.965254 -0.512129 0.417787
H 3.338764 0.771178 -2.492936
H 0.803848 0.988691 -2.392029
H 3.050165 -3.378351 1.013496
H 3.386295 -2.003353 2.098816
H 4.531322 -2.420636 0.811067
H 1.110845 -2.674686 1.861194
H -0.127793 -1.407644 1.830812
H -0.233225 -2.781419 0.704924
H -1.269406 -0.944079 0.071333
H 6.979488 1.690151 -1.033166
H -3.652832 0.856252 -1.618875
H -8.033680 -0.074210 -1.735242
H -7.529025 -0.920067 2.529016
H -9.051513 -0.533225 0.542910


