%chk=000034766.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034766

0 1
 S   -2.665500      0.4751000     -0.4858000    
 O   0.7999000     -0.7506000     -0.8418000    
 O    1.895200      -1.370000       1.113400    
 N    1.214400      -2.967100     -0.4255000    
 C  -0.1110000       1.140500      0.3161000    
 C   -1.315400      0.3589000      0.7263000    
 C   0.8946000      0.5508000     -0.4497000    
 C   2.4999999E-03   2.474200      0.7085000    
 C    2.013800       1.294900     -0.8233000    
 C    1.121600       3.218300      0.3350000    
 C   -3.870000     -0.5684000      0.3658000    
 C    2.127300       2.628600     -0.4309000    
 C   -5.153300     -0.6652000     -0.4372000    
 C    1.357500      -1.681700      5.4800000E-02
 C    1.688400      -4.138400      0.2743000    
 H   -1.069000     -0.6948000      0.8895000    
 H   -1.682700      0.7328000       1.689800    
 H  -0.7734000       2.947500       1.304500    
 H    2.800900      0.8424000      -1.420400    
 H   -3.448700      -1.569100      0.5044000    
 H   -4.085700     -0.1433000       1.351100    
 H    1.209900       4.256900      0.6402000    
 H    2.998500       3.208000     -0.7218000    
 H   -5.616800      0.3176000     -0.5755000    
 H   -4.978700      -1.109900      -1.423000    
 H   -5.874800      -1.299700      8.8399999E-02
 H   0.7483000      -3.097000      -1.318200    
 H   0.8295000      -4.780200      0.4851000    
 H    2.188900      -3.870300       1.207600    
 H    2.383700      -4.669000     -0.3807000    


%chk=000034766-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000034766

0 1
S -2.270886 0.117488 -0.521690
O 1.047065 -0.524397 -0.762774
O 0.826096 -1.533277 1.382314
N 0.679087 -2.745940 -0.628777
C 0.063301 1.461086 0.416365
C -1.175528 0.756382 0.912767
C 1.111438 0.824325 -0.306176
C 0.223155 2.847057 0.685580
C 2.251203 1.533557 -0.739210
C 1.359661 3.569556 0.264701
C -3.404586 -0.997630 0.515697
C 2.380910 2.908580 -0.454343
C -4.419099 -1.692680 -0.403857
C 0.833556 -1.612629 0.129457
C 0.471059 -4.063871 -0.026632
H -0.910425 -0.124345 1.520192
H -1.789004 1.447813 1.513338
H -0.572652 3.363088 1.235555
H 3.020260 0.991382 -1.297784
H -2.765897 -1.730425 1.040476
H -3.913795 -0.366220 1.265245
H 1.444050 4.637480 0.491940
H 3.268446 3.454581 -0.791204
H -5.046117 -0.955103 -0.935780
H -3.910357 -2.317912 -1.159481
H -5.087260 -2.345653 0.187985
H 0.659030 -2.626787 -1.641737
H -0.527076 -4.469024 -0.277919
H 0.541127 -3.953662 1.067153
H 1.243136 -4.781020 -0.360399


