%chk=000076523.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000076523

0 1
 Cl   2.278200      -2.375300      0.1113000    
 S    2.500000      0.8504000      4.4799998E-02
 O    2.291300       2.186000      0.5807000    
 O    3.492400     -2.7899999E-02  0.6437000    
 O   -2.456400       2.204800      0.5752000    
 O   -3.723200      0.6848000     -0.5434000    
 N    2.804400      0.9659000      -1.631400    
 N   -2.795900      -1.870700      2.8800000E-02
 C   0.9587000      1.6600000E-02  4.1099999E-02
 C  -0.2027000      0.7884000      8.1000002E-03
 C   -1.452100      0.1683000      3.7000000E-03
 C   0.8708000      -1.375100      7.0100002E-02
 C   -1.540200      -1.223500      3.2699998E-02
 C  -0.3786000      -1.995200      6.5899998E-02
 C   -2.646700       1.002500     -3.1399999E-02
 H  -0.1295000       1.871700     -3.9500002E-02
 H  -0.4507000      -3.080700      8.8399999E-02
 H    2.733200       1.893700      -2.066600    
 H    3.552300      0.3799000      -2.022200    
 H   -3.653900      -1.337100      1.6400000E-02
 H   -2.839200      -2.881100      5.2099999E-02
 H   -3.264600       2.759900      0.5474000    


%chk=000076523-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000076523

0 1
Cl 2.306004 -2.365811 -0.369862
S 2.498531 1.012331 -0.015239
O 2.074394 2.584006 0.011326
O 3.512267 0.392119 1.089642
O -2.543663 2.340967 0.346090
O -3.959527 0.508820 0.295197
N 3.160843 0.716716 -1.702516
N -2.841885 -1.919642 0.037735
C 0.883199 0.047130 -0.039214
C -0.283187 0.802739 0.087390
C -1.550893 0.171431 0.117589
C 0.813510 -1.360416 -0.156796
C -1.634637 -1.268409 0.009872
C -0.418901 -2.013076 -0.133350
C -2.777144 0.969948 0.255840
H -0.212691 1.892846 0.166285
H -0.456858 -3.102394 -0.229724
H 3.439475 1.633158 -2.091302
H 3.933768 0.034088 -1.646925
H -3.693559 -1.351294 0.137466
H -2.888500 -2.933236 -0.033907
H -3.412947 2.814279 0.440301


