%chk=000070659.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000070659

0 1
 S    2.318600      0.6743000     -0.5205000    
 O    3.546400     -8.1699997E-02 -0.7056000    
 O    1.890600       1.617100      -1.540400    
 N    2.384700       1.478500      0.9834000    
 N   -4.382700       1.096500      0.1794000    
 C  -0.3398000     -6.0500000E-02 -0.1606000    
 C    1.001400     -0.4622000     -0.2719000    
 C   -1.341500      -1.040200      3.8600001E-02
 C    1.349900      -1.810600     -0.1878000    
 C  -0.7087000       1.292100     -0.2428000    
 C  -0.9725000      -2.392800      0.1208000    
 C   -2.682500     -0.6385000      0.1498000    
 C   0.3649000      -2.773900      8.2000000E-03
 C   -3.031000      0.7098000      6.5700002E-02
 C   -2.046000       1.673200     -0.1302000    
 C    2.648000      0.7186000       2.213800    
 H    2.378400      -2.149500     -0.2661000    
 H  -5.1000002E-03   2.106600     -0.3556000    
 H   -1.725500      -3.163100      0.2740000    
 H   -3.460500      -1.384900      0.3032000    
 H   0.6365000      -3.823500      7.4800000E-02
 H   -2.305700       2.727400     -0.1890000    
 H    1.876000       2.363400       1.098700    
 H    3.298300     -0.1390000       2.024500    
 H    1.705400      0.3792000       2.650500    
 H    3.149100       1.372600       2.932900    
 H   -4.636400       2.073700      0.1191000    
 H   -5.099100      0.3973000      0.3223000    


%chk=000070659-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000070659

0 1
S 2.386191 0.745242 -0.469283
O 3.728684 -0.150856 -0.650713
O 1.996235 1.941975 -1.497491
N 2.592342 1.583901 1.166837
N -4.530648 1.092234 0.119431
C -0.422720 -0.024463 -0.204693
C 0.929031 -0.485567 -0.273653
C -1.440684 -1.036692 0.044442
C 1.312989 -1.817089 -0.158484
C -0.845832 1.339324 -0.362221
C -1.041871 -2.411992 0.170429
C -2.809557 -0.649331 0.149842
C 0.294796 -2.796634 0.062398
C -3.200285 0.696652 0.014419
C -2.187549 1.686997 -0.252552
C 2.997222 0.687783 2.270182
H 2.369051 -2.092783 -0.243450
H -0.107576 2.102690 -0.630511
H -1.816166 -3.167096 0.349893
H -3.563613 -1.424448 0.334604
H 0.577592 -3.850562 0.150125
H -2.489785 2.732556 -0.389542
H 1.746677 2.155499 1.331665
H 3.871136 0.104816 1.935106
H 2.207068 -0.007256 2.625839
H 3.321078 1.326846 3.110749
H -4.795764 2.065114 -0.003349
H -5.266842 0.413039 0.289181


