%chk=000034576.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000034576

0 1
 O   -6.129900     -0.2407000      0.1702000    
 O    6.077800       1.200700     -0.2469000    
 O    6.140900     -0.9931000     -0.1977000    
 N  -5.4200001E-02 -5.5000000E-02  0.5693000    
 N  -0.6286000     -9.6400000E-02 -0.5440000    
 N    5.506400      8.8200003E-02 -0.1451000    
 C    1.332400     -1.9300001E-02  0.3913000    
 C   -2.022100     -0.1326000     -0.3645000    
 C    4.098500      5.1800001E-02  3.5500001E-02
 C   -4.780600     -0.2052000     -5.2999998E-03
 C    1.989300       1.205600      0.2754000    
 C    2.058500      -1.208800      0.3293000    
 C   -2.741800       1.056500     -0.3032000    
 C   -2.671200      -1.357700     -0.2475000    
 C    3.372300       1.241200      9.7400002E-02
 C    3.441400      -1.173300      0.1514000    
 C   -4.124500       1.020200     -0.1230000    
 C   -4.053900      -1.394300     -6.7400001E-02
 C   -6.810800       1.011900      0.2248000    
 H    1.431900       2.137700      0.3232000    
 H    1.555100      -2.168100      0.4193000    
 H   -2.237500       2.014900     -0.3946000    
 H   -2.112600      -2.288700     -0.2953000    
 H    3.850400       2.213600      1.1200000E-02
 H    3.974400      -2.119600      0.1080000    
 H   -4.627000       1.980600     -8.3700001E-02
 H   -4.559400      -2.351800      2.3600001E-02
 H   -6.487200       1.608700       1.084300    
 H   -7.874500      0.7958000      0.3683000    
 H   -6.720600       1.560400     -0.7191000    


%chk=000034576-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000034576

0 1
O -6.304436 -0.251690 -0.095379
O 6.406807 1.057922 0.252420
O 6.240815 -1.188179 -0.119127
N 0.033961 0.514627 0.109254
N -0.683485 -0.571398 -0.076901
N 5.717319 -0.020649 0.069047
C 1.446314 0.287786 0.084772
C -2.088471 -0.373458 -0.059618
C 4.241582 0.087315 0.075272
C -4.912700 -0.218650 -0.070308
C 2.247281 1.445529 0.286626
C 2.068171 -0.979724 -0.123023
C -2.738917 0.879186 0.141697
C -2.875843 -1.544589 -0.264209
C 3.649390 1.353704 0.283163
C 3.466388 -1.081477 -0.127767
C -4.139089 0.960663 0.137266
C -4.274002 -1.472545 -0.270477
C -7.036465 1.007639 0.101867
H 1.741406 2.403036 0.443269
H 1.432941 -1.856375 -0.276366
H -2.121826 1.769184 0.298136
H -2.357254 -2.496428 -0.416214
H 4.287978 2.227254 0.435376
H 3.975910 -2.036056 -0.283670
H -4.625071 1.928255 0.293355
H -4.895808 -2.358381 -0.426370
H -6.821658 1.441154 1.096643
H -8.098068 0.730586 0.037202
H -6.790267 1.738959 -0.690738


