%chk=000198969.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000198969

0 1
Cl 2.459374 -1.969793 1.779049
Cl 4.022243 -2.730830 -0.483582
S -4.906201 0.127879 1.226794
O 3.350110 3.158161 1.178458
O 1.578617 -1.685803 -1.510994
N 1.601218 0.380130 -0.551980
C 0.482138 0.824987 -1.435397
C 1.950073 1.279982 0.568121
C -0.859423 0.626427 -0.774696
C 3.182697 2.130587 0.200071
C 2.034420 -0.941984 -0.664528
C -1.583151 1.724583 -0.285913
C -1.386819 -0.666715 -0.651561
C -2.825951 1.531954 0.319748
C -2.629387 -0.866293 -0.043216
C -3.340518 0.233844 0.438077
C 3.172201 -1.390468 0.268025
C -5.368829 -1.614703 1.197277
H 0.529486 0.237953 -2.389408
H 0.654070 1.889141 -1.711672
H 2.115062 0.718904 1.512664
H 1.091558 1.960084 0.794699
H 3.028782 2.700799 -0.737748
H 4.104187 1.531179 0.112697
H -1.183470 2.733234 -0.381010
H -0.818852 -1.521878 -1.032160
H -3.384515 2.391038 0.693781
H -3.020459 -1.878357 0.044148
H 3.909765 -0.583584 0.495826
H 3.642195 2.783636 2.034167
H -6.357583 -1.694554 1.672593
H -4.670653 -2.240398 1.764795
H -5.453586 -2.005442 0.176779


%chk=000198969-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000198969

0 1
Cl 2.489360 -2.286728 1.589050
Cl 4.506831 -2.522702 -0.706912
S -5.088143 0.287477 1.138926
O 3.161432 3.122946 1.436809
O 1.851879 -1.662297 -1.835122
N 1.621289 0.278646 -0.556280
C 0.528279 0.765827 -1.452261
C 1.932932 1.119228 0.620273
C -0.849769 0.626323 -0.820200
C 3.041528 2.164120 0.335039
C 2.197977 -0.949302 -0.850094
C -1.626398 1.766422 -0.494869
C -1.383136 -0.656538 -0.539155
C -2.901027 1.634114 0.093848
C -2.656181 -0.800506 0.050733
C -3.424621 0.345636 0.372604
C 3.304375 -1.408906 0.127246
C -5.381422 -1.554600 1.341538
H 0.601157 0.170780 -2.378307
H 0.732567 1.824762 -1.697757
H 2.197758 0.490423 1.490161
H 1.012496 1.659993 0.904051
H 2.771130 2.777256 -0.540089
H 4.011859 1.666968 0.118448
H -1.238276 2.770806 -0.707136
H -0.800441 -1.550293 -0.791202
H -3.486517 2.527950 0.336897
H -3.036938 -1.806699 0.250061
H 3.892788 -0.598707 0.572492
H 3.526539 2.670332 2.238484
H -6.374073 -1.639908 1.809740
H -4.623280 -2.000347 2.004177
H -5.393157 -2.058775 0.362709


