%chk=000141939.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141939

0 1
 S    5.222700     -0.5243000     -0.1178000    
 O  -0.3478000      -1.590000     -0.3679000    
 O   -2.912100     -0.8498000      0.3597000    
 N    2.580000      6.1999999E-02  0.4499000    
 C   0.3368000      0.7012000     -0.3250000    
 C  -0.6472000     -0.2747000     -0.1666000    
 C   -1.941700      9.3199998E-02  0.2002000    
 C   2.6200000E-02   2.044900     -0.1167000    
 C    1.728600      0.3270000     -0.7158000    
 C   -2.252400       1.437000      0.4083000    
 C   -1.268500       2.413000      0.2499000    
 C  -0.5347000      -2.471900      0.7363000    
 C   -3.687800      -1.182200     -0.7899000    
 C    3.698200     -0.1853000      0.1952000    
 H   0.7834000       2.815700     -0.2338000    
 H    1.705700     -0.5472000      -1.382100    
 H    2.155600       1.140700      -1.321300    
 H   -3.258500       1.730800      0.6953000    
 H   -1.510300       3.459100      0.4129000    
 H   -1.502800      -2.974100      0.6558000    
 H  -0.4510000      -1.955800       1.699200    
 H   0.2467000      -3.236300      0.6917000    
 H   -3.048200      -1.572900      -1.587600    
 H   -4.240000     -0.3066000      -1.145600    
 H   -4.405400      -1.957000     -0.5064000    


%chk=000141939-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000141939

0 1
S 4.247099 -1.311757 1.665246
O -0.415386 -1.456754 -0.637853
O -2.971640 -0.704407 0.545128
N 2.491013 -0.125141 -0.230811
C 0.261743 0.880664 -0.566637
C -0.712410 -0.115272 -0.298532
C -1.976832 0.249830 0.249263
C -0.018733 2.231017 -0.252863
C 1.599830 0.473106 -1.183298
C -2.231881 1.599394 0.580090
C -1.254407 2.587680 0.333385
C -0.279992 -2.371493 0.524872
C -3.487108 -1.479268 -0.607076
C 3.239697 -0.627555 0.568352
H 0.737461 2.998775 -0.454166
H 1.426851 -0.256727 -1.996485
H 2.092433 1.363997 -1.618443
H -3.203164 1.848164 1.019634
H -1.460372 3.632702 0.587130
H -1.176966 -2.320236 1.168420
H 0.623555 -2.111779 1.106461
H -0.173037 -3.378928 0.094487
H -2.669014 -1.996265 -1.138828
H -4.022227 -0.806834 -1.304799
H -4.191015 -2.206415 -0.174775


