%chk=000073169.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073169

0 1
 S   0.6545000      -2.072500     -0.2610000    
 O    1.778400       2.305600     -0.3541000    
 O    4.248000       1.071600      0.4732000    
 O    5.034000     -0.7571000     -0.6529000    
 N    1.791800      0.1373000      0.6178000    
 N   -4.544800     -0.1008000     -0.1171000    
 N   -2.564700     -0.7629000      0.4006000    
 N   -3.841600      -1.129200      0.3841000    
 C   0.4877000     -0.5308000      0.7479000    
 C  -7.1199998E-02  0.7344000      0.1412000    
 C    1.286900       1.290800      9.5600002E-02
 C    2.766800     -0.6374000      5.1300000E-02
 C   -1.265000       1.194100     -0.2170000    
 C    2.372100      -1.824600     -0.4220000    
 C   -2.548700      0.4723000     -9.1600001E-02
 C    4.131100     -0.1493000     -9.6100003E-02
 C   -3.740200      0.9498000     -0.4349000    
 C   -5.975100     -0.1911000     -0.2652000    
 H   0.2288000     -0.7238000       1.795200    
 H   -1.312800       2.194100     -0.6409000    
 H    3.002100      -2.547200     -0.9222000    
 H   -4.107100       1.876600     -0.8530000    
 H   -6.356600      0.7420000     -0.6871000    
 H   -6.200400      -1.024000     -0.9357000    
 H   -6.413700     -0.3621000      0.7210000    
 H    5.157300       1.430500      0.3910000    


%chk=000073169-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000073169

0 1
S 0.599634 -1.970925 -0.537378
O 1.831567 2.502933 -0.595858
O 4.544009 0.890398 0.803088
O 5.238376 -1.006504 -0.366226
N 1.842156 0.262703 0.475934
N -4.643161 -0.121952 -0.067161
N -2.557686 -0.698104 0.385860
N -3.817007 -1.158979 0.434870
C 0.482136 -0.359240 0.576524
C -0.098166 0.920964 0.004137
C 1.296741 1.477394 -0.151786
C 2.876676 -0.613920 0.025543
C -1.338075 1.380074 -0.315849
C 2.389022 -1.772459 -0.538511
C -2.555871 0.612035 -0.138011
C 4.311462 -0.303768 0.112352
C -3.888380 0.967939 -0.425058
C -6.092076 -0.335801 -0.138651
H 0.151470 -0.704673 1.563787
H -1.424082 2.382963 -0.752512
H 3.017490 -2.544725 -0.984203
H -4.313870 1.878127 -0.836664
H -6.575263 0.562558 -0.551888
H -6.310469 -1.199375 -0.787050
H -6.491011 -0.534869 0.868897
H 5.521979 1.073505 0.803916


