%chk=000068144.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000068144

0 1
 O   0.7968000       1.469300      -1.140400    
 O    2.283500      -1.586500     -3.5300002E-02
 O    4.418400      -1.169600     -0.6805000    
 N    1.822500      0.8304000      0.8418000    
 C  -0.5279000       1.377800      0.8845000    
 C   -1.637200      0.4935000      0.4242000    
 C   0.7481000       1.241100      6.5600000E-02
 C   -2.540400      0.9501000     -0.5359000    
 C   -1.771500     -0.7901000      0.9534000    
 C    3.143100      0.6238000      0.2951000    
 C   -3.577800      0.1231000     -0.9667000    
 C   -2.808900      -1.617100      0.5224000    
 C   -3.712100      -1.160300     -0.4375000    
 C    3.363400     -0.7856000     -0.1906000    
 H  -0.8340000       2.430700      0.8276000    
 H  -0.3336000       1.197900       1.949100    
 H   -2.445800       1.947300     -0.9575000    
 H   -1.072700      -1.158100       1.700000    
 H    1.688400      0.6388000       1.830100    
 H    3.860100      0.8336000       1.093800    
 H    3.299500       1.309700     -0.5426000    
 H   -4.280800      0.4784000      -1.714600    
 H   -2.913100      -2.616800      0.9338000    
 H   -4.519600      -1.804400     -0.7732000    
 H    2.451400      -2.496900     -0.3596000    


%chk=000068144-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000068144

0 1
O 0.714076 2.246640 -0.534998
O 3.465171 -1.488668 0.880165
O 4.924397 -0.796998 -0.794683
N 1.638154 0.338344 0.395564
C -0.519278 1.142546 1.293771
C -1.711865 0.440648 0.641461
C 0.654435 1.304845 0.315514
C -2.310254 0.981060 -0.526755
C -2.239188 -0.753501 1.192913
C 2.777658 0.367834 -0.520545
C -3.413698 0.336897 -1.127485
C -3.346534 -1.397625 0.592914
C -3.937277 -0.853885 -0.569988
C 3.841568 -0.662399 -0.193414
H -0.805272 2.163999 1.603248
H -0.205737 0.591879 2.199501
H -1.898002 1.898124 -0.963367
H -1.789060 -1.178421 2.099247
H 1.584939 -0.429722 1.066810
H 3.247125 1.369966 -0.520040
H 2.456270 0.200535 -1.568773
H -3.866737 0.763945 -2.029390
H -3.745793 -2.318464 1.033216
H -4.795529 -1.350846 -1.035997
H 4.180232 -2.156635 1.058110


