%chk=000099799.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000099799

0 1
 Cl   2.130300      -2.437700      -1.798100    
 S    1.391500      0.4406000       1.409000    
 O    1.453800      5.6000002E-02   2.848300    
 O   -1.201300       3.153900     -0.8121000    
 O   0.6749000       2.616100      0.1929000    
 O   -4.698200      -1.896900     -0.1191000    
 O   -4.859400      9.3599997E-02  -1.030600    
 N  -0.4914000       2.341700     -0.1742000    
 N   -4.212500     -0.7732000     -0.3946000    
 C    2.179100     -0.9388000      0.4759000    
 C    1.903300     -0.8234000      -1.031200    
 C    3.671600      -1.023300      0.8181000    
 C    2.802100      0.1991000      -1.737200    
 C    4.517700      3.3199999E-02  0.1089000    
 C    4.281900      3.4800000E-02  -1.397100    
 C  -0.2907000      0.1146000      0.8538000    
 C   -1.028800       1.062900      0.1450000    
 C  -0.8532000      -1.127700       1.148800    
 C   -2.328300      0.7690000     -0.2685000    
 C   -2.152500      -1.421500      0.7353000    
 C   -2.890000     -0.4732000      2.6699999E-02
 H    1.723200      -1.855400      0.8669000    
 H   0.8666000     -0.5785000      -1.262800    
 H    4.045300      -2.012600      0.5235000    
 H    3.833200     -0.9502000       1.900300    
 H    2.489900       1.209200      -1.445600    
 H    2.667800      0.1429000      -2.824400    
 H    5.578700     -0.1516000      0.3129000    
 H    4.288600       1.025700      0.5150000    
 H    4.853400      0.8503000      -1.855000    
 H    4.665800     -0.8968000      -1.829300    
 H  -0.3147000      -1.879200       1.719600    
 H   -2.908800       1.503800     -0.8215000    
 H   -2.559500      -2.397400      0.9873000    


%chk=000099799-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000099799

0 1
Cl 3.130691 -0.608173 -3.242053
S 1.217439 0.999003 0.670087
O 1.696788 0.409814 2.152568
O -2.160689 1.803107 -2.362117
O 0.021388 1.814624 -1.695377
O -4.790277 -2.084123 1.878379
O -5.369898 -1.036811 -0.066235
N -1.217522 1.449797 -1.566794
N -4.529858 -1.331705 0.864920
C 2.053166 -0.324504 -0.722088
C 2.860705 0.531625 -1.691811
C 2.829944 -1.361926 0.084676
C 4.226045 0.982129 -1.168372
C 4.209380 -0.861818 0.583402
C 5.026695 -0.177483 -0.535504
C -0.569164 0.281673 0.570380
C -1.540266 0.577733 -0.414185
C -0.915825 -0.525455 1.668360
C -2.850260 0.062572 -0.329636
C -2.209340 -1.071479 1.768349
C -3.155145 -0.764987 0.764189
H 1.142018 -0.719127 -1.196808
H 2.265093 1.349921 -2.119677
H 2.957515 -2.242386 -0.577730
H 2.224900 -1.689651 0.952121
H 4.042674 1.765664 -0.400375
H 4.789197 1.464794 -1.986272
H 4.771887 -1.721745 0.992218
H 4.048623 -0.156954 1.420107
H 5.976872 0.211862 -0.125469
H 5.286884 -0.909228 -1.324183
H -0.140679 -0.689979 2.431440
H -3.599021 0.301586 -1.089792
H -2.500559 -1.718369 2.600180


