%chk=000187616.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000187616

0 1
Cl -4.298973 -1.475393 -2.126934
S -3.087474 -1.463432 0.939320
O -3.132214 -1.174230 2.344946
O -3.746874 -2.626017 0.406342
O -0.564697 0.223151 1.117217
O 3.314125 2.402323 -0.762552
O 6.661147 -1.219062 -0.768536
N -1.406711 -1.823859 0.534011
N 0.951626 -1.502849 0.622341
N 3.303066 -1.485704 0.457671
N 2.036388 0.526284 -0.102836
N 4.485672 0.509226 -0.248643
C -3.440346 -0.043477 0.031695
C -3.973413 -0.023008 -1.259939
C -3.176826 1.188726 0.661373
C -4.265121 1.179251 -1.914888
C -3.461032 2.395126 0.021475
C -0.360902 -0.920250 0.780646
C -4.008554 2.389883 -1.266689
C 2.111720 -0.777349 0.328885
C 4.442987 -0.800534 0.147145
C 5.764947 -1.536611 0.285679
C 3.253490 1.121543 -0.362272
C 2.038322 3.118879 -0.878414
H -1.199658 -2.748734 0.127951
H -2.730709 1.200470 1.668682
H -4.687518 1.169945 -2.920933
H -3.251913 3.339276 0.524915
H -4.234483 3.332828 -1.769446
H 1.090994 -2.505998 0.817692
H 6.225644 -1.292001 1.266087
H 5.631818 -2.637833 0.192721
H 6.767257 -0.236478 -0.853412
H 1.515861 3.115589 0.085012
H 1.424790 2.655042 -1.657060
H 2.390365 4.117876 -1.160752


%chk=000187616-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000187616

0 1
Cl -3.354933 -1.555049 -2.191767
S -3.001522 -1.347117 1.207527
O -2.973317 -0.793018 2.723857
O -3.751285 -2.736591 0.857319
O -0.476271 0.469621 0.919011
O 3.647951 2.356647 -0.756250
O 6.933063 -1.029993 -0.337284
N -1.280515 -1.705861 0.637800
N 1.013500 -1.356521 0.537143
N 3.311257 -1.578258 0.307430
N 2.257480 0.568748 -0.140360
N 4.661846 0.321174 -0.360901
C -3.547513 0.096567 0.098531
C -3.728072 -0.028375 -1.289383
C -3.800236 1.297085 0.783565
C -4.191748 1.086003 -2.020077
C -4.266718 2.407991 0.049666
C -0.260563 -0.746384 0.712041
C -4.464061 2.297608 -1.346060
C 2.224137 -0.740690 0.227404
C 4.499928 -0.986897 -0.006382
C 5.771896 -1.810066 0.034457
C 3.504013 1.047855 -0.407948
C 2.410069 3.181535 -0.802229
H -1.176314 -2.666557 0.293321
H -3.620728 1.343356 1.862539
H -4.332842 0.998764 -3.101182
H -4.468488 3.351309 0.565415
H -4.826992 3.156743 -1.919397
H 1.116572 -2.355581 0.739354
H 5.894110 -2.218126 1.058614
H 5.655733 -2.673094 -0.652099
H 6.603287 -0.101589 -0.519016
H 1.862254 3.105650 0.150314
H 1.758834 2.835753 -1.621484
H 2.778984 4.199958 -0.984988


