%chk=000057966.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000057966

0 1
 O  -0.5570000     -0.2237000      -1.311700    
 O   -3.081000      0.9196000     -0.8447000    
 O    2.928200      -1.965200     -0.4903000    
 N    1.919100     -3.0300001E-02  9.9399999E-02
 N   -4.265500     -0.4723000      0.5488000    
 N    3.107500     -0.9043000      0.1184000    
 N    2.533800       2.402000      0.1940000    
 C  -0.5646000      3.0999999E-02  9.2699997E-02
 C   -1.862400     -0.5207000      0.6876000    
 C   0.6909000     -0.5766000      0.7204000    
 C   -3.103800      6.4499997E-02  3.5500001E-02
 C    2.255000       1.276100      0.1500000    
 H  -0.5532000       1.120600      0.2119000    
 H   -1.902800     -0.3134000       1.763100    
 H   -1.903700      -1.608100      0.5458000    
 H   0.7114000     -0.3808000       1.799400    
 H   0.6628000      -1.664700      0.5837000    
 H  -0.5629000      -1.187800      -1.439400    
 H   -4.261300      -1.177600       1.278600    
 H   -5.173300     -0.1740000      0.2077000    


%chk=000057966-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000057966

0 1
O -0.587416 -0.560110 -1.223677
O -3.222475 1.414664 0.388424
O 2.013665 -2.073896 -0.758795
N 1.922985 0.019305 0.118201
N -4.133997 -0.695619 0.058791
N 2.595986 -0.952314 -0.745040
N 2.942091 2.359432 0.157401
C -0.605677 -0.008334 0.134038
C -1.824834 -0.511526 0.945696
C 0.706411 -0.331280 0.893657
C -3.112726 0.155606 0.435558
C 2.458824 1.262978 0.136479
H -0.708112 1.080346 -0.015705
H -1.714384 -0.210338 2.005611
H -1.875751 -1.616886 0.911792
H 0.741502 0.213362 1.852596
H 0.775047 -1.418594 1.093274
H -0.330187 -1.518721 -1.189824
H -4.023003 -1.707310 0.043539
H -5.000750 -0.286462 -0.291118


