%chk=000084434.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084434

0 1
 O   -2.068600      -3.053300       1.129400    
 O   5.5199999E-02  -2.546700      0.9020000    
 O    4.515000      -1.338600      -1.495100    
 O    2.379100      -1.790300      -1.264900    
 O   -4.944800       2.080400     -0.8118000    
 O   -5.485800      9.7800002E-02 -4.0100001E-02
 N   0.8301000     -0.3454000      4.1499998E-02
 N   -1.159500      -2.253300      0.8067000    
 N    3.378000      -1.066400      -1.043500    
 N   -4.626300      0.9466000     -0.3790000    
 C  -0.5393000     -4.0700000E-02 -5.6100000E-02
 C    1.972400      0.4533000      0.2762000    
 C   -1.519000     -0.9673000      0.3149000    
 C  -0.9252000       1.215200     -0.5345000    
 C    3.215700      0.1047000     -0.2516000    
 C   -2.870900     -0.6407000      0.2084000    
 C   -3.250100      0.6136000     -0.2698000    
 C   -2.277200       1.541600     -0.6412000    
 C    1.841600       1.606600       1.049700    
 C    4.328200      0.9093000     -5.2999998E-03
 C    2.954000       2.411200       1.295800    
 C    4.197300       2.062400      0.7684000    
 H    1.040600      -1.329300     -7.7500001E-02
 H  -0.1931000       1.950800     -0.8570000    
 H   -3.633000      -1.361000      0.4970000    
 H   -2.535600       2.525900      -1.023300    
 H   0.8932000       1.891500       1.496800    
 H    5.314100      0.6729000     -0.3974000    
 H    2.853800       3.306000       1.903200    
 H    5.063500       2.688500      0.9618000    


%chk=000084434-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000084434

0 1
O -2.240482 -3.119709 1.123107
O -0.061405 -2.862456 0.510839
O 4.591836 -1.259766 -1.619103
O 2.647695 -2.125375 -0.806079
O -4.941232 2.235473 -0.682457
O -5.558679 0.105574 -0.126419
N 0.845824 -0.413150 0.118482
N -1.273747 -2.407669 0.659644
N 3.513692 -1.160198 -0.920781
N -4.670270 1.013877 -0.354707
C -0.493867 -0.059505 0.017561
C 1.946822 0.450799 0.276587
C -1.549297 -1.014891 0.262761
C -0.902413 1.255292 -0.384139
C 3.252892 0.102889 -0.206760
C -2.909208 -0.662927 0.149330
C -3.247072 0.642072 -0.229188
C -2.246317 1.606084 -0.512575
C 1.829412 1.684880 0.981792
C 4.361796 0.964016 -0.026394
C 2.934634 2.531647 1.167392
C 4.209234 2.181350 0.654444
H 1.057613 -1.430284 0.051679
H -0.134824 1.986967 -0.645603
H -3.683689 -1.405283 0.359033
H -2.545621 2.603900 -0.843722
H 0.867229 1.950815 1.427428
H 5.327144 0.648671 -0.431109
H 2.806800 3.461031 1.731852
H 5.068897 2.841179 0.800805


