%chk=000085492.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085492

0 1
 Cl  -1.807600      -1.531600       2.042800    
 Cl  -5.834200      -3.862400      -1.323700    
 S   -6.205200       1.141300      0.3932000    
 O    6.628500      -2.777700     -0.9733000    
 O    7.656600       1.681700      0.5808000    
 O   -6.614200      0.8586000       1.763100    
 O   -6.444300       2.466200     -0.1633000    
 N    5.729000     -0.2763000     -4.1099999E-02
 N   -6.915500     -2.0600000E-02 -0.6396000    
 N   0.2590000      0.7821000      0.5274000    
 N  -0.4053000     -1.1600000E-02 -0.1786000    
 C    4.351500     -7.0000002E-03  9.7400002E-02
 C    6.384200      -1.222000      0.8403000    
 C    6.504400      0.3788000      -1.075800    
 C    3.729600      0.9059000     -0.7545000    
 C    2.367400       1.172600     -0.6163000    
 C    3.611200     -0.6528000       1.087900    
 C    6.139300      -2.640500      0.3549000    
 C    6.903700       1.772700     -0.6222000    
 C    1.627200      0.5266000      0.3740000    
 C    2.249100     -0.3859000       1.226400    
 C    1.723400       2.154100      -1.540200    
 C   -4.501200      0.7956000      0.2328000    
 C   -3.890500     -0.1186000       1.091300    
 C   -3.750400       1.434900     -0.7540000    
 C   -1.778500      0.2450000     -2.4300000E-02
 C   -6.705900      -1.452900     -0.3840000    
 C   -2.529100     -0.3940000      0.9627000    
 C   -2.388900       1.159700     -0.8825000    
 C   -6.093100      -2.122200      -1.601700    
 H    6.101900      -1.091800       1.890800    
 H    7.467400      -1.042500      0.8205000    
 H    5.996200      0.3904000      -2.046300    
 H    7.425700     -0.1918000      -1.252600    
 H    4.261500       1.428600      -1.541600    
 H    4.033300      -1.369900       1.782900    
 H    5.080000      -2.911000      0.3546000    
 H    6.675300      -3.350500      0.9929000    
 H    6.043800       2.420800     -0.4338000    
 H    7.530700       2.246900      -1.384100    
 H    1.681300     -0.8930000       2.002300    
 H    1.053500       1.637800      -2.235300    
 H    1.153000       2.900400     -0.9770000    
 H    2.462600       2.701800      -2.134700    
 H   -7.316700      0.2558000      -1.543300    
 H   -4.466100     -0.6161000       1.867700    
 H   -4.206300       2.144800      -1.438400    
 H   -7.690700      -1.891600     -0.1829000    
 H   -6.105000      -1.628800      0.5105000    
 H   -1.813900       1.661600      -1.656500    
 H    6.470700      -3.698900      -1.241800    
 H    7.908800       2.587400      0.8289000    
 H   -6.741500      -2.018000      -2.477600    
 H   -5.122700      -1.679100      -1.846900    


%chk=000085492-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085492

0 1
Cl -2.076057 -1.724555 2.487925
Cl -7.573750 -4.035150 -0.857057
S -6.430877 1.014393 0.373032
O 7.538652 -2.609891 -0.690488
O 8.144920 1.639870 0.611779
O -7.061767 0.321985 1.710616
O -6.705110 2.566269 -0.039052
N 5.917884 -0.206660 -0.067172
N -7.015326 0.047566 -1.137658
N 0.323566 0.663211 -0.233002
N -0.430145 -0.043302 0.595680
C 4.543876 -0.007798 -0.093624
C 6.561338 -1.103875 0.915635
C 6.824458 0.462837 -1.022510
C 3.938718 0.934925 -0.995148
C 2.553090 1.150062 -1.041015
C 3.665964 -0.740692 0.785296
C 6.621925 -2.569997 0.461135
C 7.281372 1.855135 -0.561467
C 1.700210 0.407561 -0.151222
C 2.291086 -0.532224 0.752688
C 1.967481 2.159287 -2.009674
C -4.582304 0.705784 0.409806
C -4.101295 -0.259399 1.307965
C -3.756643 1.465575 -0.440169
C -1.817007 0.247586 0.492021
C -7.682724 -1.242956 -0.823040
C -2.711914 -0.477674 1.334445
C -2.375127 1.226926 -0.388420
C -6.728003 -2.381714 -1.204379
H 6.041194 -1.038670 1.887323
H 7.587576 -0.736188 1.078891
H 6.341844 0.539077 -2.012844
H 7.710053 -0.181137 -1.148689
H 4.565730 1.523675 -1.670156
H 4.071100 -1.478323 1.482521
H 5.612714 -2.934458 0.179621
H 7.010827 -3.189096 1.298087
H 6.407471 2.487183 -0.302363
H 7.848403 2.338810 -1.385891
H 1.621780 -1.088568 1.416507
H 1.244623 1.678621 -2.692088
H 1.410466 2.946815 -1.472116
H 2.758955 2.635709 -2.613434
H -7.613996 0.735430 -1.630334
H -4.781247 -0.796310 1.976431
H -4.186533 2.226244 -1.098723
H -8.620727 -1.321769 -1.401944
H -7.951283 -1.304413 0.251649
H -1.675911 1.782433 -1.020243
H 7.554053 -3.519305 -1.078891
H 8.395832 2.508964 1.011645
H -6.488994 -2.379116 -2.276885
H -5.807424 -2.375696 -0.602797


