%chk=000036677.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000036677

0 1
 O    1.244400      -1.541500     -8.6900003E-02
 O  -0.9757000     -0.3378000      -1.718500    
 O    3.011900      -2.025400       1.306200    
 N   -1.583600      -2.012800     -0.2348000    
 N   -4.872900      0.3436000      0.8752000    
 N    4.704600       1.620800     -2.3600001E-02
 C  -0.5925000      -2.977100     -0.6554000    
 C   0.6953000      -2.833900      0.1348000    
 C   -1.714400     -0.7379000     -0.7998000    
 C   -2.744500      0.1260000     -0.2508000    
 C    2.875100      0.1076000      0.2495000    
 C    2.409500      -1.267100      0.5622000    
 C   -2.625000       1.510100     -0.3080000    
 C   -3.877700     -0.4028000      0.3461000    
 C    1.960100       1.090900     -3.9600000E-02
 C   -3.628300       2.311700      0.2256000    
 C    4.214400      0.3912000      0.2511000    
 C    2.426100       2.369000     -0.3277000    
 C   -4.721900       1.685000      0.8009000    
 C    3.795200       2.580300     -0.3066000    
 H  -0.3983000      -2.830000      -1.723300    
 H   -1.020800      -3.973500     -0.5106000    
 H   0.4955000      -2.963900       1.205300    
 H    1.411100      -3.596800     -0.1919000    
 H   -2.163300      -2.279500      0.5539000    
 H   -1.756500       1.981600     -0.7600000    
 H   -4.065100      -1.469700      0.4087000    
 H   0.8900000      0.9139000     -3.3500001E-02
 H   -3.555900       3.392700      0.1933000    
 H    4.967900     -0.3575000      0.4713000    
 H    1.738800       3.175400     -0.5568000    
 H   -5.531300       2.265200       1.231600    
 H    4.209400       3.559600     -0.5226000    


%chk=000036677-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000036677

0 1
O 1.340704 -1.621857 -0.263434
O -1.149704 -0.267668 -1.803373
O 2.867584 -2.045065 1.450891
N -1.584574 -1.984636 -0.283465
N -4.829136 0.354947 1.315703
N 4.513412 1.858876 0.780739
C -0.600860 -2.913205 -0.854763
C 0.722466 -2.952120 -0.077842
C -1.794322 -0.714149 -0.802747
C -2.843709 0.120881 -0.111376
C 2.880329 0.103989 0.274089
C 2.403947 -1.275167 0.575091
C -2.822689 1.523040 -0.321656
C -3.880313 -0.409632 0.701423
C 2.250391 0.929942 -0.694105
C -3.794701 2.328142 0.304049
C 4.001664 0.611569 0.982136
C 2.773233 2.222083 -0.910226
C -4.769419 1.705702 1.120085
C 3.895981 2.641397 -0.157369
H -0.404957 -2.583320 -1.888944
H -1.027312 -3.933926 -0.883501
H 0.585639 -3.147979 1.001948
H 1.397445 -3.725410 -0.490592
H -2.052559 -2.250020 0.584397
H -2.050811 1.942006 -0.974973
H -3.995736 -1.490856 0.853585
H 1.381263 0.558906 -1.247358
H -3.804546 3.413704 0.167448
H 4.498600 -0.011753 1.733355
H 2.323489 2.894387 -1.647124
H -5.536728 2.295766 1.633489
H 4.327530 3.638826 -0.300282


