%chk=000017109.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000017109

0 1
 S   -2.811200       1.575600      6.0000003E-04
 S   -3.008300      -1.380200      3.0000001E-04
 O   -5.086200      0.2428000      7.9999998E-04
 N  -9.7900003E-02   1.308800     -6.0000003E-04
 N  -0.2837000      -1.476200     -5.0000002E-04
 C    1.008200      0.5430000     -6.9999998E-04
 C   0.9143000     -0.8641000     -6.9999998E-04
 C    3.431100      0.3694000      6.9999998E-04
 C    2.267600       1.136800     -3.0000001E-04
 C   -1.282300      0.6764000     -3.0000001E-04
 C    2.083500      -1.620300       0.000000    
 C   -1.373500     -0.6920000     -3.0000001E-04
 C    3.338700      -1.014500      1.0000000E-03
 C    4.766100       1.032900      1.9999999E-04
 C   -3.866500      0.1614000     -9.9999997E-05
 H    2.343000       2.223200      1.3000000E-03
 H    2.026300      -2.707000      6.9999998E-04
 H    4.230500      -1.634900      3.5000001E-03
 H    5.063000       1.280700       1.024200    
 H    5.533200      0.3851000     -0.4377000    
 H    4.746500       1.952800     -0.5940000    


%chk=000017109-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000017109

0 1
S -2.863895 1.652233 -0.095799
S -3.071212 -1.469856 0.043436
O -5.214826 0.239233 -0.045146
N -0.134999 1.340027 -0.065360
N -0.324010 -1.515887 0.062765
C 1.014277 0.557557 -0.023038
C 0.915334 -0.889052 0.041991
C 3.465788 0.407010 -0.001407
C 2.296655 1.179225 -0.043486
C -1.304718 0.706819 -0.043804
C 2.110914 -1.665671 0.084222
C -1.401247 -0.736133 0.020837
C 3.351554 -1.026896 0.062728
C 4.839830 1.046974 -0.021497
C -3.983690 0.157822 -0.034668
H 2.335731 2.271890 -0.092470
H 2.020263 -2.754759 0.132518
H 4.269264 -1.626107 0.094931
H 5.413045 0.786202 0.888118
H 5.430489 0.692967 -0.887249
H 4.777854 2.146103 -0.079522


