%chk=000156494.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000156494

0 1
 Cl  -4.793500      -2.716000       1.045400    
 S   0.4447000     -0.2258000      -1.358600    
 O  -2.8999999E-02  0.7489000      -2.324900    
 O    1.242500      -1.349800      -1.816800    
 N   -1.802000       1.356000      0.1518000    
 N    4.933100      0.1659000     -0.1698000    
 C  -0.9967000     -0.8895000     -0.5680000    
 C   -1.958500     -5.7799999E-02  2.2100000E-02
 C    1.208200      0.5557000     -3.5000000E-02
 C  -0.6456000       2.103400      0.3859000    
 C   0.6310000       1.543900      0.6536000    
 C   -2.864300       2.249400      9.7400002E-02
 C   -1.202200      -2.273300     -0.6449000    
 C    2.549100      4.6399999E-02  0.2403000    
 C   -3.143600     -0.6416000      0.5042000    
 C   -1.009200       3.440000      0.4424000    
 C   -2.397800       3.531300      0.2510000    
 C   -2.372800      -2.836100     -0.1412000    
 C   -3.344600      -2.021200      0.4273000    
 C    2.754000      -1.001600       1.135000    
 C    3.666400      0.5892000     -0.3796000    
 C    4.042500      -1.464700       1.377200    
 C    5.088600     -0.8527000      0.7055000    
 H    1.204000       2.022800       1.446000    
 H   -3.875200       1.910600     -8.7700002E-02
 H  -0.4758000      -2.935400      -1.106500    
 H   -3.910300     -3.7599999E-02  0.9851000    
 H  -0.3312000       4.262800      0.6272000    
 H   -3.000700       4.428100      0.2379000    
 H   -2.516600      -3.911300     -0.2097000    
 H    1.916400      -1.466500       1.649300    
 H    3.578100       1.407500      -1.088600    
 H    4.222200      -2.279200       2.069400    
 H    6.112600      -1.177000      0.8593000    


%chk=000156494-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000156494

0 1
Cl -5.233607 -2.404437 1.286587
S 0.390521 -0.580398 -1.337774
O 0.052715 0.427404 -2.573716
O 1.141426 -2.006308 -1.635977
N -1.862845 1.344133 -0.072382
N 4.993513 0.808223 0.789113
C -1.226658 -1.045934 -0.472371
C -2.129492 -0.058132 -0.020680
C 1.317093 0.388241 0.050702
C -0.666277 2.023475 0.316417
C 0.650548 1.472629 0.558082
C -2.880658 2.298744 -0.224625
C -1.508662 -2.418933 -0.404720
C 2.709501 0.010704 0.323159
C -3.361716 -0.501249 0.531423
C -0.992008 3.390874 0.424631
C -2.362426 3.564229 0.058327
C -2.739702 -2.855049 0.126358
C -3.646237 -1.876184 0.579827
C 3.152068 -1.335143 0.462618
C 3.692849 1.039307 0.474797
C 4.505594 -1.583437 0.769761
C 5.387396 -0.492918 0.939842
H 1.236623 2.082092 1.262397
H -3.873394 2.003753 -0.556522
H -0.764990 -3.126128 -0.788898
H -4.065381 0.223799 0.947949
H -0.281958 4.173266 0.689923
H -2.907443 4.503251 -0.013044
H -2.987503 -3.917885 0.181195
H 2.451419 -2.161214 0.320565
H 3.419180 2.089481 0.314772
H 4.872722 -2.608231 0.879768
H 6.441586 -0.647224 1.194498


