%chk=000174223.chk
%nprocshared=4
%mem=7500MB
#p opt=(loose) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000174223

0 1
 S    3.332600       1.704500      0.1170000    
 S  -1.7800000E-02  0.8998000      5.7000000E-02
 O    2.147500       2.654200     -0.4773000    
 O    3.485300       2.029800       1.522700    
 O    4.460200       1.750400     -0.7937000    
 N  -0.5705000      -1.615500     -8.4600002E-02
 N   -6.646700      0.6429000      1.8800000E-02
 C    2.684500      6.8999998E-02  2.2100000E-02
 C    1.307000     -0.2023000      1.4000000E-03
 C   0.8126000      -1.508100     -7.2899997E-02
 C    3.572500      -1.008200     -3.3900000E-02
 C   -1.105000     -0.4184000     -2.0400001E-02
 C    1.731700      -2.578300     -0.1284000    
 C    3.104500      -2.315500     -0.1082000    
 C   -2.523000     -0.1473000     -1.0500000E-02
 C    5.053000     -0.7940000     -1.5000000E-02
 C   -3.421800      -1.152500      0.3440000    
 C   -2.991600       1.119900     -0.3552000    
 C   -4.791800     -0.8899000      0.3536000    
 C   -4.361500       1.382300     -0.3453000    
 C   -5.261600      0.3773000      8.9999996E-03
 H    1.376600      -3.603300     -0.1872000    
 H    3.795000      -3.154100     -0.1542000    
 H    5.417900     -0.4820000     -0.9981000    
 H    5.361200     -8.8000000E-02  0.7622000    
 H    5.575500      -1.728100      0.2267000    
 H   -3.079600      -2.146900      0.6196000    
 H   -2.348300       1.937200     -0.6662000    
 H   -5.483200      -1.681000      0.6323000    
 H   -4.716600       2.372000     -0.6212000    
 H    1.378600       2.799700      0.1222000    
 H   -6.987800       1.561400     -0.2316000    
 H   -7.300000     -8.5400000E-02  0.2749000    


%chk=000174223-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000174223

0 1
S 3.632017 1.709870 -0.090376
S 0.002979 1.105774 -0.096809
O 2.159674 2.788328 -0.442750
O 4.191142 2.132078 1.372889
O 4.638715 1.794495 -1.348984
N -0.606047 -1.524526 0.049334
N -6.844584 0.457595 -0.027545
C 2.743100 0.027323 -0.044686
C 1.342859 -0.106906 -0.036611
C 0.789199 -1.440418 0.036531
C 3.630572 -1.080488 0.025078
C -1.190651 -0.336138 -0.006600
C 1.647816 -2.559905 0.096183
C 3.038810 -2.373386 0.091467
C -2.628301 -0.102540 -0.011757
C 5.143194 -0.946646 0.033331
C -3.517222 -1.217449 0.052875
C -3.193780 1.202523 -0.080868
C -4.905009 -1.037413 0.048228
C -4.582368 1.393952 -0.086286
C -5.467323 0.274994 -0.021963
H 1.204032 -3.557520 0.151046
H 3.703560 -3.241593 0.144852
H 5.520950 -0.592161 -0.942046
H 5.490683 -0.224923 0.795787
H 5.605911 -1.921672 0.254591
H -3.086092 -2.221918 0.106023
H -2.540216 2.081703 -0.132993
H -5.569639 -1.908297 0.098479
H -4.994192 2.408571 -0.141173
H 2.354385 3.666432 -0.004362
H -7.248227 1.388894 -0.077777
H -7.476549 -0.337030 0.016494


