%chk=000159871.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159871

0 1
 Cl  -4.721300       3.296900     -0.1319000    
 S   -1.558800      -2.087600      0.2575000    
 O   0.6980000      -1.033300      -1.597700    
 O   -1.580800      -2.719400      -1.047500    
 O   -2.064800      -2.787800       1.422200    
 N    2.154200     -0.6580000      0.1581000    
 N   1.9200001E-02  -1.517100      0.5841000    
 C    3.254300     -0.1526000     -0.6283000    
 C    3.141400       1.365100     -0.8278000    
 C    3.630100       2.135700      0.3988000    
 C    5.074800       1.771100      0.7490000    
 C    4.532100     -0.5652000      4.3900002E-02
 C    5.357500      0.3021000      0.6469000    
 C   0.9548000      -1.060500     -0.3979000    
 C   -2.452300     -0.5665000      0.1475000    
 C   -2.566100      6.3299999E-02  -1.079800    
 C   -3.022000     -3.2900002E-02   1.290700    
 C   -3.271300       1.263600      -1.166800    
 C   -3.727200       1.167400       1.203800    
 C   -3.851800       1.815700     -2.4900001E-02
 H    3.212100     -0.6265000      -1.616700    
 H    2.109000       1.653600      -1.059000    
 H    3.753300       1.660200      -1.690500    
 H    2.978300       1.913600       1.253300    
 H    3.556500       3.214100      0.2184000    
 H    5.291500       2.113700       1.767100    
 H    5.762000       2.301500      7.9099998E-02
 H    4.802200      -1.617700      1.6899999E-02
 H    6.280400     -6.3600004E-02   1.087700    
 H    2.246200     -0.6879000       1.169600    
 H   0.3302000      -1.544300       1.563400    
 H   -2.118400     -0.3483000      -1.979000    
 H   -2.929700     -0.5174000       2.257800    
 H   -3.359500       1.758400      -2.130600    
 H   -4.172800       1.587000       2.102200    


%chk=000159871-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159871

0 1
Cl -5.303466 3.045950 -0.840458
S -1.575066 -2.013956 0.587600
O 0.415300 -0.419950 -1.177605
O -1.528651 -3.026048 -0.669866
O -2.009912 -2.531398 2.068162
N 2.237380 -0.612662 0.279407
N 0.101734 -1.332851 0.955123
C 3.189259 0.078401 -0.635293
C 3.193837 1.617128 -0.431722
C 4.026080 2.024741 0.803314
C 5.498027 1.578800 0.636918
C 4.571239 -0.524641 -0.443323
C 5.607650 0.158438 0.113786
C 0.905498 -0.772203 -0.061773
C -2.613435 -0.502219 0.155245
C -2.604145 -0.025762 -1.165008
C -3.398463 0.036037 1.187454
C -3.440194 1.071913 -1.467771
C -4.229269 1.135819 0.876989
C -4.231948 1.632019 -0.443163
H 2.820691 -0.139351 -1.655467
H 2.150750 1.972375 -0.352220
H 3.628481 2.084198 -1.338059
H 3.595193 1.551891 1.709232
H 3.974009 3.117981 0.960606
H 6.042184 1.664221 1.598272
H 6.022074 2.261852 -0.065505
H 4.709540 -1.557208 -0.789879
H 6.590179 -0.329161 0.187654
H 2.594944 -0.932902 1.180477
H 0.461100 -1.711941 1.839809
H -1.955494 -0.477893 -1.919000
H -3.374871 -0.399537 2.191266
H -3.467544 1.483831 -2.479910
H -4.861391 1.590486 1.644308


