%chk=000093964.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000093964

0 1
 S   -1.410700      -1.484100      4.6799999E-02
 O    2.823100      0.2946000      0.6182000    
 O    1.850900       1.980100     -0.5691000    
 N  -0.6209000       1.081100     -9.1399997E-02
 C   0.3816000      -1.157700     -0.1134000    
 C   0.4811000      0.2707000      0.4506000    
 C   -1.858600      0.2935000      7.5400002E-02
 C    1.169000      -2.158100      0.7337000    
 C   0.7615000      -1.297100      -1.593900    
 C   -2.826200      0.5887000      -1.073800    
 C   -2.513500      0.6286000       1.419100    
 C    1.762900      0.9597000      9.7700000E-02
 H   0.4134000      0.2779000       1.548000    
 H  -0.6861000       1.972300      0.3986000    
 H    2.248800      -2.060300      0.5875000    
 H   0.9659000      -2.038200       1.804100    
 H   0.9164000      -3.190900      0.4635000    
 H    1.831700      -1.115000      -1.743400    
 H   0.5566000      -2.308000      -1.966300    
 H   0.2209000     -0.5889000      -2.232200    
 H   -3.105400       1.649200      -1.086600    
 H   -2.382100      0.3588000      -2.049800    
 H   -3.753100      1.0500000E-02 -0.9801000    
 H   -1.856600      0.4168000       2.270900    
 H   -2.780300       1.691200       1.471400    
 H   -3.439300      5.9000000E-02   1.565000    
 H    3.673900      0.7290000      0.3951000    


%chk=000093964-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000093964

0 1
S -1.505201 -1.547095 -0.206415
O 2.817396 0.611852 0.842775
O 1.896598 1.743258 -0.964390
N -0.671298 1.081309 -0.068320
C 0.387750 -1.209601 -0.143459
C 0.460666 0.290520 0.423097
C -1.937218 0.393290 0.105860
C 1.062390 -2.198839 0.825952
C 0.957776 -1.330710 -1.573837
C -2.972260 0.851078 -0.930192
C -2.472065 0.494403 1.546114
C 1.753504 0.975043 0.011828
H 0.435579 0.217127 1.524320
H -0.503739 1.434198 -1.020950
H 2.136276 -1.955868 0.934428
H 0.590965 -2.160005 1.823271
H 0.978317 -3.233840 0.450654
H 2.062189 -1.239209 -1.574060
H 0.698129 -2.315576 -1.997643
H 0.543276 -0.557676 -2.244640
H -3.204245 1.923349 -0.782285
H -2.601297 0.700357 -1.959096
H -3.908135 0.278739 -0.820347
H -1.714347 0.186106 2.285236
H -2.767164 1.539361 1.760114
H -3.349876 -0.161682 1.675469
H 3.650933 1.053512 0.522119


