%chk=000021088.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000021088

0 1
 O    3.578600      -1.756200     -0.2963000    
 O   0.2688000       3.656000     -4.2700000E-02
 N   0.3171000     -4.3099999E-02  5.0999999E-02
 N   -3.930200     -0.8401000     -0.5978000    
 C  -0.3894000      -1.009200      0.8832000    
 C   -1.907800     -0.8223000      0.8136000    
 C    1.764100     -0.2473000      0.1388000    
 C  -2.6900001E-02   1.324900      0.4437000    
 C   -2.501000     -0.9912000     -0.5838000    
 C    2.165300      -1.620100     -0.3693000    
 C   0.6612000       2.348700     -0.4405000    
 H  -0.2030000      -2.035300      0.5520000    
 H  -7.0000000E-02 -0.9418000       1.931500    
 H   -2.350400      -1.593400       1.461000    
 H   -2.228200      0.1231000       1.265300    
 H    2.133600     -0.1005000       1.162700    
 H    2.320300      0.4543000     -0.4892000    
 H   0.2179000       1.516700       1.497200    
 H   -1.097300       1.526500      0.3366000    
 H   -2.070200     -0.2527000      -1.267800    
 H   -2.237800      -1.980800     -0.9751000    
 H    1.866500      -1.760900      -1.413200    
 H    1.754700      -2.442100      0.2211000    
 H   0.3842000       2.218200      -1.491600    
 H    1.750100       2.339200     -0.3646000    
 H   -4.362600      -1.534200      1.0100000E-02
 H   -4.288700      -1.017700      -1.535000    
 H    3.836100      -1.655400      0.6360000    
 H   0.5383000       3.775100      0.8841000    


%chk=000021088-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000021088

0 1
O 3.337409 -1.873254 -0.786334
O 0.252718 3.829494 -0.167163
N 0.349137 0.089866 0.514925
N -3.605358 -1.216991 -1.005082
C -0.539307 -0.794699 1.313645
C -2.009503 -0.769567 0.842340
C 1.750202 -0.377674 0.431051
C 0.203398 1.532592 0.808497
C -2.190601 -1.298720 -0.594412
C 1.942264 -1.410436 -0.700686
C 0.370931 2.392159 -0.462404
H -0.155922 -1.829609 1.220074
H -0.493860 -0.538281 2.401430
H -2.610031 -1.383309 1.546909
H -2.423670 0.255294 0.887356
H 2.101484 -0.819693 1.399213
H 2.414405 0.480550 0.221720
H 0.931425 1.876923 1.588128
H -0.805345 1.722112 1.215427
H -1.589246 -0.667837 -1.273298
H -1.759443 -2.331200 -0.651039
H 1.737430 -0.940427 -1.675078
H 1.245069 -2.265539 -0.572482
H -0.445578 2.178584 -1.169255
H 1.336583 2.167670 -0.964423
H -4.238592 -1.802505 -0.451180
H -3.766431 -1.322916 -2.010615
H 3.576000 -2.334082 0.057705
H 0.977733 4.089895 0.456031


