%chk=000090349.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000090349

0 1
 Cl  -3.529400      -4.211800      0.2283000    
 S   -1.069800       1.786700      0.8559000    
 O   -1.821000      0.6593000       1.379700    
 O  -0.9574000       3.012800       1.626600    
 O   -4.657900      0.7554000      -2.135800    
 N    4.481600     -4.4500001E-02 -0.2676000    
 N    5.484200      0.8424000     -0.2853000    
 N   -4.046400       1.764300     -0.1278000    
 C   0.5649000       1.204700      0.5167000    
 C   0.8147000     -0.1350000      0.2579000    
 C   -1.712300       2.206400     -0.7344000    
 C    3.161800      0.3761000     -2.6000000E-03
 C    2.120100     -0.5517000     -3.1000001E-03
 C    4.831300      -1.404000     -0.5445000    
 C    1.592900       2.137300      0.5203000    
 C    2.898100       1.720500      0.2590000    
 C   -3.131500       2.736200     -0.6613000    
 C    6.329200      -1.310000     -0.7684000    
 C  -0.2427000      -1.126800      0.2511000    
 C    6.537300      0.1514000     -0.5655000    
 C  -0.5751000      -1.795700       1.427300    
 C  -0.9228000      -1.408800     -0.9320000    
 C   -1.591900      -2.750500       1.420500    
 C   -1.939700      -2.363500     -0.9389000    
 C   -2.274400      -3.034400      0.2375000    
 C   -4.736200      0.8509000     -0.9138000    
 C   -5.607600     -6.7599997E-02 -9.9799998E-02
 H   -1.054400       2.969400      -1.162500    
 H   -1.669700       1.315700      -1.365500    
 H    2.303900      -1.604400     -0.2040000    
 H    4.337200      -1.788400      -1.444100    
 H    4.612800      -2.071400      0.2968000    
 H    1.411900       3.190500      0.7124000    
 H    3.684100       2.470700      0.2660000    
 H   -3.467200       3.030600      -1.661400    
 H   -3.185400       3.617800     -1.4100000E-02
 H    6.629400      -1.597900      -1.779000    
 H    6.907400      -1.879200     -3.6300000E-02
 H    7.541300      0.5895000     -0.6556000    
 H  -5.1600002E-02  -1.587900       2.357500    
 H  -0.6707000     -0.8995000      -1.859000    
 H   -4.179100       1.743800      0.8794000    
 H   -1.841800      -3.265500       2.344500    
 H   -2.463000      -2.574100      -1.868100    
 H   -6.213100     -0.6888000     -0.7652000    
 H   -4.979600     -0.7132000      0.5204000    
 H   -6.273900      0.5174000      0.5404000    


%chk=000090349-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000090349

0 1
Cl -3.652305 -4.069890 -0.580023
S -0.937543 2.267218 0.757868
O -1.828417 1.561832 1.956939
O -0.593360 3.861869 0.914324
O -5.559698 0.843438 -1.538347
N 4.598483 -0.095235 -0.182887
N 5.732476 0.723398 -0.039093
N -4.098248 1.442051 0.170056
C 0.729904 1.394010 0.491875
C 0.866165 0.027744 0.134300
C -1.944712 2.082565 -0.908739
C 3.320909 0.409998 0.042992
C 2.185129 -0.438289 -0.098128
C 4.942095 -1.497983 -0.571668
C 1.837104 2.256288 0.636218
C 3.133959 1.773792 0.420714
C -3.408465 2.445175 -0.645012
C 6.498603 -1.452988 -0.667499
C -0.261335 -0.945015 -0.027066
C 6.796937 -0.002819 -0.301234
C -1.171646 -1.218720 1.028864
C -0.395488 -1.662331 -1.247574
C -2.195741 -2.176704 0.865872
C -1.421948 -2.614890 -1.427687
C -2.310502 -2.855043 -0.361898
C -5.136529 0.685284 -0.349242
C -5.734566 -0.349275 0.597702
H -1.425029 2.797338 -1.566431
H -1.808468 1.037002 -1.223408
H 2.313267 -1.493633 -0.357863
H 4.466012 -1.757923 -1.535025
H 4.586289 -2.208216 0.197285
H 1.657542 3.304307 0.901351
H 4.005302 2.421901 0.531752
H -3.941086 2.482177 -1.615760
H -3.471956 3.447423 -0.179457
H 6.866143 -1.696275 -1.680577
H 6.984200 -2.154621 0.034066
H 7.787544 0.450129 -0.245998
H -1.085674 -0.682052 1.976692
H 0.295227 -1.457794 -2.073426
H -3.711242 1.278888 1.108472
H -2.892053 -2.386940 1.682769
H -1.532740 -3.148187 -2.375914
H -6.819942 -0.170775 0.685382
H -5.601966 -1.355571 0.162328
H -5.284131 -0.327458 1.604736


