%chk=000075220.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000075220

0 1
 Cl  -4.870900      0.1274000      -1.362400    
 S   0.5672000       1.636200       1.463500    
 O   0.6832000       3.128800       1.362500    
 N   0.1739000     -0.6827000     -0.5544000    
 N  -0.1723000      -4.020000       2.218600    
 C   7.4999998E-03  -2.038800      -1.085600    
 C  -0.9895000      6.9600001E-02 -0.2759000    
 C    1.477400     -0.1384000     -0.5180000    
 C  -0.9274000       1.201000      0.5585000    
 C    1.765900      0.9739000      0.2944000    
 C  -0.5197000      -2.981900     -4.8000002E-03
 C   -2.237000     -0.2376000     -0.8597000    
 C    2.520200     -0.6386000      -1.326400    
 C   0.3583000      -3.071200       1.247200    
 C   -2.075900       1.975700      0.7987000    
 C    3.051300       1.543300      0.2961000    
 C   -3.372900      0.5399000     -0.6216000    
 C    3.793600     -6.4199999E-02  -1.324700    
 C   -3.291900       1.648800      0.2074000    
 C    4.059000       1.028900     -0.5134000    
 H  -0.6216000      -2.057600      -1.982000    
 H   0.9367000      -2.509800      -1.411700    
 H  -0.6133000      -3.982800     -0.4471000    
 H   -1.534700      -2.692000      0.2926000    
 H   -2.351200      -1.084100      -1.530900    
 H    2.378900      -1.444800      -2.038500    
 H   0.4365000      -2.094400       1.734700    
 H    1.372900      -3.378200      0.9711000    
 H   -2.036900       2.836900       1.462100    
 H    3.284600       2.388300      0.9401000    
 H    4.570500     -0.4646000      -1.969600    
 H   -4.164700       2.264200      0.4082000    
 H    5.047300       1.478200     -0.5070000    
 H  -0.2562000      -4.939400       1.786200    
 H   -1.119700      -3.747400       2.478600    


%chk=000075220-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000075220

0 1
Cl -4.722562 0.197580 -1.594805
S 0.684443 1.393014 1.734774
O 0.790333 3.034689 2.029893
N 0.307515 -0.806104 -0.405455
N -0.607063 -4.240195 2.324947
C 0.176119 -2.191583 -0.923318
C -0.865730 -0.025399 -0.195534
C 1.561691 -0.122299 -0.520934
C -0.836404 1.113845 0.649871
C 1.856669 0.992436 0.303617
C -0.619769 -3.115362 0.028429
C -2.084568 -0.293179 -0.881293
C 2.529317 -0.465844 -1.506307
C 0.106444 -3.366280 1.381480
C -1.912581 2.000556 0.780734
C 3.008064 1.777201 0.160086
C -3.174053 0.577074 -0.705754
C 3.718183 0.284476 -1.632793
C -3.119020 1.735919 0.093505
C 3.960706 1.416107 -0.819710
H -0.268260 -2.197886 -1.941593
H 1.197029 -2.599987 -1.016270
H -0.770925 -4.085235 -0.488308
H -1.626820 -2.703077 0.228289
H -2.172530 -1.139521 -1.566013
H 2.339781 -1.288646 -2.202087
H 0.292642 -2.397582 1.881462
H 1.102654 -3.808710 1.180642
H -1.796636 2.885636 1.416846
H 3.139150 2.650935 0.809065
H 4.448076 -0.002561 -2.397689
H -3.984767 2.395749 0.187488
H 4.875387 2.003802 -0.944079
H -0.750358 -5.201178 2.002644
H -1.453059 -3.835792 2.734968


