%chk=000070806.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070806

0 1
 S    3.115600      0.2891000      8.6199999E-02
 O    3.369000       1.017900       1.523300    
 O    2.971500       1.310100     -0.9357000    
 O    4.065400     -0.7994000     -5.7799999E-02
 N   -1.371900     -0.5821000      4.4100001E-02
 C   -1.573400      0.4651000     -0.9672000    
 C   -2.651600      -1.174800      0.4574000    
 C   -2.476300       1.579100     -0.4353000    
 C   -3.589800     -0.1143000       1.035900    
 C   -3.811800       1.026600      4.9699999E-02
 C  -0.4693000      -1.615600     -0.4626000    
 C   0.8963000      -1.014700     -0.7863000    
 C    1.526300     -0.3870000      0.4482000    
 H   -2.005100      4.6599999E-02  -1.885800    
 H  -0.6380000      0.9615000      -1.238900    
 H   -2.477600      -1.933100       1.230500    
 H   -3.140700      -1.676900     -0.3879000    
 H   -2.649200       2.323500      -1.220900    
 H   -1.973500       2.097200      0.3914000    
 H   -3.164800      0.2840000       1.966000    
 H   -4.551400     -0.5720000       1.294200    
 H   -4.399700       1.822200      0.5205000    
 H   -4.390400      0.6619000     -0.8078000    
 H  -0.8779000      -2.100100      -1.358700    
 H  -0.3359000      -2.398600      0.2947000    
 H   0.8691000     -0.3203000      -1.631500    
 H    1.545300      -1.832700      -1.127500    
 H    1.654800      -1.124300       1.247200    
 H   0.9192000      0.4421000      0.8251000    
 H    2.822700       1.821000       1.694200    


%chk=000070806-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000070806

0 1
S 3.075133 0.443849 0.185433
O 3.136570 1.166454 1.905452
O 2.811771 1.618266 -0.897947
O 4.336985 -0.550105 -0.023298
N -1.423220 -0.582572 -0.101250
C -1.723426 0.442132 -1.138451
C -2.673066 -1.150265 0.473297
C -2.573450 1.590408 -0.558101
C -3.548893 -0.049973 1.104923
C -3.878038 1.050696 0.070340
C -0.507943 -1.642707 -0.586157
C 0.944199 -1.135466 -0.785915
C 1.457413 -0.525174 0.518489
H -2.267427 -0.023293 -2.002871
H -0.773943 0.849520 -1.529584
H -2.393645 -1.898247 1.239287
H -3.268690 -1.684785 -0.313676
H -2.797028 2.318198 -1.361234
H -1.980320 2.118423 0.213401
H -3.002000 0.395874 1.958211
H -4.476533 -0.504722 1.502393
H -4.448811 1.870929 0.544625
H -4.523078 0.625927 -0.726923
H -0.852379 -2.091947 -1.552133
H -0.507734 -2.456533 0.164526
H 0.972745 -0.379500 -1.592099
H 1.580993 -1.980312 -1.105352
H 1.755015 -1.254738 1.287484
H 0.770275 0.233054 0.924833
H 3.985423 1.688607 1.986999


