%chk=000094837.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000094837

0 1
 S    2.495000     -0.7671000      -1.209400    
 O   -2.416800       1.878900      0.8302000    
 N    3.438800      -1.712300       1.310900    
 C   -2.575500     -0.8633000      4.8099998E-02
 C   -1.315000     -6.7100003E-02 -3.2800000E-02
 C   -2.461600      -2.055600       1.017400    
 C   -3.057400      -1.351600      -1.331600    
 C   -1.291100       1.270500      0.3621000    
 C  -0.1532000     -0.6744000     -0.5095000    
 C    1.056300       1.393400     -0.1964000    
 C    1.032300      5.5900000E-02 -0.5915000    
 C  -0.1055000       2.000700      0.2804000    
 C    2.301800       2.218000     -0.2654000    
 C    3.052100      -1.326300      0.2875000    
 H   -3.402900     -0.2547000      0.4261000    
 H   -1.732900      -2.796800      0.6723000    
 H   -3.427600      -2.562100       1.118800    
 H   -2.152800      -1.718300       2.013000    
 H   -3.172400     -0.5097000      -2.023500    
 H   -4.028600      -1.851100      -1.245300    
 H   -2.357200      -2.063300      -1.782000    
 H  -0.1703000      -1.717100     -0.8186000    
 H  -9.9900000E-02   3.042600      0.5918000    
 H    3.070700       1.816600      0.4026000    
 H    2.686600       2.256600      -1.289800    
 H    2.120700       3.254100      4.2500000E-02
 H   -2.862600       1.278200       1.450100    


%chk=000094837-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000094837

0 1
S 2.451148 -0.869250 -1.312098
O -2.385415 1.994574 0.942931
N 4.204014 -1.278271 1.027630
C -2.711065 -0.891371 0.055366
C -1.405986 -0.090147 -0.006147
C -2.603717 -2.067564 1.063482
C -3.145819 -1.391102 -1.348096
C -1.303301 1.262490 0.427966
C -0.221191 -0.692932 -0.492399
C 1.099968 1.368177 -0.125967
C 0.992999 0.015578 -0.553224
C -0.078129 1.967577 0.368176
C 2.403113 2.139388 -0.167402
C 3.467113 -1.102994 0.097683
H -3.533290 -0.234761 0.420001
H -1.827630 -2.786446 0.743293
H -3.563138 -2.612750 1.130519
H -2.333180 -1.709621 2.072669
H -3.252409 -0.552001 -2.058233
H -4.112310 -1.923968 -1.287659
H -2.401095 -2.093389 -1.764850
H -0.244888 -1.735823 -0.825272
H -0.064651 3.004087 0.718758
H 3.127815 1.738339 0.566444
H 2.882586 2.066613 -1.160241
H 2.239151 3.204191 0.065475
H -3.209692 1.446076 0.959193


