%chk=000183129.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000183129

0 1
Cl -3.358607 1.904912 1.773929
Cl 3.867788 3.184748 -0.743159
S -4.204623 -0.471111 -0.256336
F 7.282752 -0.880088 -1.118045
F 6.468942 -2.231459 0.289160
F 6.010679 -2.439334 -1.767773
O -5.138735 0.611740 -0.060489
O -4.218558 -1.242671 -1.483026
O 0.469260 3.307827 1.677851
O -1.023990 2.481705 2.995393
O 0.254309 -1.433245 -2.603588
O 1.434225 0.377017 -2.538788
N -4.259765 -1.502370 1.110398
N 1.442349 1.561347 0.037641
N -0.451047 2.532912 1.931082
N 0.539502 -0.346155 -2.139362
N 2.573446 -0.540334 -0.088139
C -2.571072 0.180544 -0.130188
C -3.884953 -2.929505 0.904469
C -5.365238 -1.257160 2.080079
C -2.188707 1.165668 0.777117
C -1.627283 -0.324723 -1.023254
C 0.135963 1.086343 -0.054930
C -0.845800 1.598290 0.864607
C -0.306679 0.145391 -1.030742
C -4.831117 -3.729634 0.014274
C -6.769833 -1.481706 1.526219
C 2.624892 0.821566 -0.237518
C 3.830211 1.492170 -0.566041
C 4.936593 -0.650616 -0.614517
C 4.992122 0.741517 -0.761520
C 3.702965 -1.255742 -0.283872
C 6.145135 -1.516318 -0.802000
H -2.854658 -2.948578 0.478374
H -3.812099 -3.409648 1.908614
H -5.194888 -1.907978 2.968042
H -5.264858 -0.202503 2.435921
H -1.926366 -1.092509 -1.771378
H -5.870113 -3.683866 0.371764
H -4.830435 -3.354964 -1.024554
H -4.540276 -4.784866 -0.026833
H -7.036918 -0.721979 0.774696
H -6.876363 -2.469904 1.055242
H -7.521841 -1.413352 2.320863
H 1.583872 2.528527 0.432998
H 5.923722 1.254574 -1.029482
H 3.602593 -2.347177 -0.162501


%chk=000183129-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000183129

0 1
Cl -3.294889 1.761056 2.047878
Cl 4.072465 3.228710 -0.024032
S -4.302467 -0.442907 -0.320764
F 7.393763 -0.939349 -0.618053
F 6.116837 -2.819670 -0.479105
F 6.371166 -1.764721 -2.465277
O -5.325026 0.815362 -0.363645
O -4.177077 -1.446947 -1.606538
O 0.593030 3.284763 1.754104
O -0.628072 2.058992 3.237433
O 0.264424 -1.322626 -2.824050
O 1.338856 0.687843 -2.746668
N -4.545250 -1.317615 1.285171
N 1.533112 1.521193 0.006080
N -0.243832 2.328502 2.045944
N 0.509103 -0.182169 -2.282282
N 2.584535 -0.550428 -0.485406
C -2.495171 0.178310 -0.093334
C -3.857660 -2.638124 1.348307
C -5.906842 -1.114311 1.858470
C -2.095229 1.089107 0.896149
C -1.600068 -0.282938 -1.063778
C 0.216719 1.070927 -0.071682
C -0.734227 1.495095 0.927805
C -0.278447 0.185115 -1.078586
C -4.529879 -3.861927 0.686728
C -7.123092 -1.630967 1.056644
C 2.688094 0.794352 -0.292234
C 3.957413 1.441684 -0.314576
C 4.990110 -0.697642 -0.769579
C 5.115608 0.696509 -0.557032
C 3.700576 -1.278033 -0.726028
C 6.194517 -1.537216 -1.073264
H -2.846279 -2.497619 0.919872
H -3.708439 -2.820029 2.431277
H -5.853654 -1.600780 2.852481
H -6.021175 -0.029710 2.031711
H -1.955798 -0.969064 -1.842480
H -5.473290 -4.135855 1.188039
H -4.727405 -3.672667 -0.381605
H -3.847586 -4.728964 0.762585
H -7.184348 -1.123216 0.078535
H -7.093485 -2.719383 0.890184
H -8.048113 -1.392609 1.613544
H 1.652867 2.457800 0.425701
H 6.095274 1.181253 -0.576058
H 3.554829 -2.351785 -0.877891


