%chk=000091937.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091937

0 1
 S   -2.772000     -0.4666000      9.9999997E-05
 S  -7.1999997E-02  -1.674800      1.5000000E-03
 O   -3.142100      -1.092100      -1.269400    
 O   -3.167400      -1.090800       1.263300    
 N  -0.4109000      0.8820000      9.9999997E-05
 N    5.032300     -0.4346000      1.3000000E-03
 C   -3.421400       1.197400      9.9999997E-05
 C   -1.044200     -0.2677000      9.9999997E-05
 C    1.341000     -0.6866000      1.4000000E-03
 C   0.9583000      0.6581000      1.9999999E-04
 C   -4.933800       1.202400       0.000000    
 C    2.690900      -1.073500      1.9000000E-03
 C    1.964400       1.648900     -1.0000000E-03
 C    3.666500     -7.3200002E-02  8.9999998E-04
 C    3.310300       1.270900     -5.0000002E-04
 H   -3.040200       1.702000      0.8929000    
 H   -3.039500       1.702400     -0.8922000    
 H   -5.311200       2.229600     -1.9000000E-03
 H   -5.331000      0.6920000     -0.8833000    
 H   -5.331500      0.6953000      0.8849000    
 H    2.965400      -2.124800      2.9000000E-03
 H    1.697000       2.701800     -2.2000000E-03
 H    4.073600       2.045500     -1.4000000E-03
 H    5.745500      0.2825000      1.3000000E-03
 H    5.297300      -1.410600      3.0000000E-03


%chk=000091937-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000091937

0 1
S -2.928236 -0.560789 -0.000581
S 0.023981 -1.932112 -0.002720
O -3.396457 -1.243350 -1.408742
O -3.395935 -1.236814 1.410957
N -0.414837 0.732882 -0.000838
N 5.118256 -0.334698 0.002747
C -3.460461 1.316892 -0.004728
C -1.024011 -0.421339 -0.001407
C 1.440272 -0.785959 -0.000373
C 0.983786 0.575116 0.000157
C -4.984309 1.352821 0.000732
C 2.802459 -1.118322 0.000545
C 1.940162 1.619673 0.001616
C 3.754783 -0.057706 0.002007
C 3.304386 1.305647 0.002474
H -2.982683 1.723345 0.898970
H -2.989266 1.717071 -0.914683
H -5.318318 2.406680 -0.001256
H -5.400524 0.857574 -0.893268
H -5.393783 0.863037 0.900824
H 3.138805 -2.160016 0.000004
H 1.598533 2.658835 0.001979
H 4.047155 2.111547 0.003504
H 5.801639 0.416986 0.003683
H 5.459902 -1.291500 0.002395


