%chk=000122465.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122465

0 1
 S    4.289300      0.9202000      -1.442900    
 N   -2.794100      0.8670000     -0.2233000    
 N    2.710500      0.6703000      0.8223000    
 C  -0.7508000     -0.4817000      3.8600001E-02
 C   -1.405100      0.7610000      3.4299999E-02
 C   0.6387000     -0.5311000      0.3025000    
 C  -0.6997000       1.938000      0.2868000    
 C    1.333000      0.6635000      0.5541000    
 C   -1.444900      -1.676300     -0.2133000    
 C   0.6669000       1.889400      0.5460000    
 C    1.293200      -1.773600      0.3066000    
 C   -3.271900       1.042300      -1.576900    
 C   -3.744000      0.7866000      0.8644000    
 C  -0.7786000      -2.902100     -0.2049000    
 C   0.5879000      -2.950700      5.4600000E-02
 C    3.369500      0.7773000     -0.1488000    
 H   -1.206000       2.900200      0.2846000    
 H   -2.512300      -1.687200     -0.4188000    
 H    1.202700       2.814600      0.7438000    
 H    2.357300      -1.860100      0.5126000    
 H   -3.141200      0.1223000      -2.155800    
 H   -2.726500       1.847200      -2.081900    
 H   -4.334600       1.306100      -1.601900    
 H   -3.490100     -2.5800001E-02   1.554100    
 H   -4.760500      0.5988000      0.5026000    
 H   -3.754300       1.725200       1.428200    
 H   -1.327000      -3.819000     -0.4002000    
 H    1.105300      -3.905700      6.2899999E-02


%chk=000122465-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000122465

0 1
S 5.534877 0.688283 0.407233
N -2.940702 0.716229 -0.375854
N 2.713959 0.735564 0.067994
C -0.814665 -0.553459 -0.089513
C -1.525253 0.699003 -0.314049
C 0.623903 -0.544778 0.074886
C -0.769407 1.873917 -0.516707
C 1.343113 0.703169 -0.082035
C -1.485674 -1.820436 -0.088880
C 0.643497 1.876315 -0.410234
C 1.307754 -1.775142 0.336866
C -3.601888 1.827272 -1.076665
C -3.734173 0.199277 0.763339
C -0.792587 -3.011766 0.143477
C 0.613519 -2.986533 0.387108
C 3.911599 0.709733 0.213453
H -1.275763 2.822755 -0.713711
H -2.552951 -1.850178 -0.325321
H 1.200444 2.808299 -0.547441
H 2.392780 -1.758891 0.481318
H -3.094934 2.029424 -2.034704
H -3.629593 2.769969 -0.482000
H -4.646065 1.539021 -1.294011
H -3.136417 -0.492777 1.373355
H -4.636061 -0.332132 0.404735
H -4.063350 1.033109 1.422403
H -1.324992 -3.968748 0.121269
H 1.151731 -3.919798 0.583988


