%chk=000163383.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163383

0 1
 Cl   5.301200       3.719900      0.7287000    
 S   -6.569300      0.6256000      -1.499100    
 O   -7.728300       1.260600     -0.8774000    
 O   -5.734100       1.371800      -2.434500    
 O   -1.142700       1.728400      0.9552000    
 O    4.596300      -1.866000     -0.6178000    
 O    8.224400     -0.1064000      -1.153400    
 O    7.327600      -1.964800     -0.3835000    
 N   -1.925700     -0.4807000      0.4830000    
 N   -1.327800      -1.692500      0.1054000    
 N   -7.121000     -0.7982000      -2.290700    
 N    1.412700      0.4806000      0.3462000    
 N    2.408000     -0.4250000      1.3000000E-03
 N    7.291400     -0.7483000     -0.6393000    
 C   -3.291000     -0.3406000      0.6755000    
 C   -4.128300      2.8000001E-02 -0.3867000    
 C   -5.502100      0.1682000     -0.1891000    
 C   -3.854500     -0.5663000       1.939000    
 C   -6.051900     -5.9000000E-02   1.072600    
 C   -5.228000     -0.4261000       2.136700    
 C   -3.535400      0.2716000      -1.739800    
 C   -1.028100      0.5654000      0.6467000    
 C   -2.998300     -0.9613000       3.098900    
 C  -4.8900001E-02  -1.499300      7.7999998E-03
 C   0.2597000     -9.4499998E-02  0.3311000    
 C   0.9864000      -2.490600     -0.3635000    
 C    3.563400      0.1512000      1.6400000E-02
 C    4.763600     -0.6883000     -0.3356000    
 C    3.776800       1.573100      0.3550000    
 C    6.107500     -4.6999998E-02 -0.3251000    
 C    5.023200       2.057200      0.3362000    
 C    6.173500       1.253200     -3.0000001E-04
 H   -7.119200      3.2699998E-02   1.252900    
 H   -5.673400     -0.6011000       3.112400    
 H   -4.077700     -0.2623000      -2.527000    
 H   -3.448900       1.343100      -1.945700    
 H   -2.519000     -0.1245000      -1.833200    
 H   -2.274200     -0.1728000       3.328400    
 H   -3.592100      -1.130100       4.004000    
 H   -2.465100      -1.893500       2.885400    
 H    1.689300      -2.657800      0.4563000    
 H    1.489700      -2.211400      -1.292400    
 H   0.4914000      -3.450100     -0.5519000    
 H   -6.758900     -0.9834000      -3.234100    
 H   -8.107200      -1.056400      -2.164000    
 H    2.943900       2.216000      0.6142000    
 H    7.131900       1.767400      3.5100002E-02


%chk=000163383-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163383

0 1
Cl 4.546183 2.302149 -3.283055
S -6.582430 1.323407 -1.167487
O -8.111503 1.153211 -0.628196
O -5.942319 2.797381 -1.406163
O -1.340268 1.618785 1.227320
O 5.158491 -0.914599 1.722582
O 8.407304 -0.312827 -0.641713
O 7.829432 0.080456 1.539103
N -1.958656 -0.630248 0.690788
N -1.300737 -1.862320 0.399784
N -6.383522 0.478801 -2.804457
N 1.428011 0.405517 0.894255
N 2.648254 -0.004069 1.004563
N 7.558741 -0.008323 0.286546
C -3.392925 -0.574188 0.758091
C -4.089222 0.219203 -0.201068
C -5.493276 0.252461 -0.041330
C -4.054660 -1.298701 1.792612
C -6.197916 -0.439580 0.953826
C -5.464947 -1.225931 1.864739
C -3.367062 0.956906 -1.306616
C -1.055727 0.432884 0.936839
C -3.272314 -2.109396 2.804172
C 0.020099 -1.641827 0.416328
C 0.290834 -0.237847 0.752527
C 1.023619 -2.724312 0.154590
C 3.693303 0.332035 0.227943
C 5.037109 -0.150416 0.723038
C 3.549201 1.068962 -1.009258
C 6.172545 0.299076 -0.132111
C 4.677971 1.361415 -1.745831
C 6.000234 0.970762 -1.323975
H -7.287092 -0.345037 1.013848
H -5.991600 -1.771848 2.653932
H -3.958067 0.940844 -2.236521
H -3.204150 2.012194 -1.024916
H -2.386157 0.497021 -1.507517
H -2.513998 -1.486702 3.314341
H -3.939898 -2.532922 3.571866
H -2.730452 -2.938245 2.314760
H 1.763626 -2.791842 0.972707
H 1.583606 -2.540622 -0.781702
H 0.508786 -3.693894 0.062764
H -6.515352 1.203857 -3.531828
H -7.081066 -0.282053 -2.877294
H 2.557086 1.408090 -1.323556
H 6.871685 1.218029 -1.938969


