%chk=000000739.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000000739

0 1
 O   0.6906000       1.146800     -0.2533000    
 O   -1.901600      -2.039300     -0.4485000    
 O   0.8323000      -2.477000      0.3336000    
 O   -1.061900       2.679800     -0.2372000    
 O    3.390100      0.9406000      0.1868000    
 N   -2.911600      0.5683000      0.4176000    
 C   -1.090800      -1.058000      0.2004000    
 C   0.3650000      -1.255700     -0.2328000    
 C   -1.596000      0.3364000     -0.1861000    
 C    1.231600     -8.2599998E-02  0.2354000    
 C  -0.6116000       1.422400      0.2643000    
 C    2.663900     -0.1817000     -0.2803000    
 H   -1.182400      -1.230600       1.280300    
 H   0.4056000      -1.355900      -1.325000    
 H   -1.724900      0.3926000      -1.274800    
 H    1.268300     -3.7700001E-02   1.332300    
 H  -0.5614000       1.489400       1.359000    
 H    2.698100     -0.1714000      -1.374800    
 H    3.165800      -1.083400      8.0399998E-02
 H   -2.836000      0.5339000       1.433800    
 H   -3.543100     -0.1883000      0.1569000    
 H   -1.827900      -1.904900      -1.408700    
 H    1.680400      -2.694400     -8.8000000E-02
 H  -0.6882000       3.367000      0.3403000    
 H    2.938700       1.738800     -0.1372000    


%chk=000000739-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000000739

0 1
O 0.715455 1.174689 -0.190149
O -1.986889 -2.107232 -0.314749
O 0.852867 -2.567621 0.273591
O -1.098619 2.662531 -0.016054
O 3.459216 1.032751 0.084037
N -2.892203 0.484040 0.588652
C -1.061112 -1.096584 0.220923
C 0.386859 -1.285569 -0.269617
C -1.604475 0.321322 -0.089094
C 1.284891 -0.125799 0.236757
C -0.619106 1.385536 0.417964
C 2.702766 -0.137467 -0.352120
H -1.095896 -1.267389 1.311733
H 0.407789 -1.285709 -1.385172
H -1.642303 0.445937 -1.201625
H 1.336225 -0.168689 1.346851
H -0.518594 1.324952 1.526347
H 2.635421 -0.180024 -1.462057
H 3.268670 -1.010446 0.015225
H -3.352808 1.375350 0.387169
H -3.503338 -0.331372 0.479328
H -1.894833 -2.134191 -1.302216
H 1.667665 -2.857028 -0.208521
H -0.530593 3.382905 0.356466
H 2.875949 1.820207 -0.079268


