%chk=000122047.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122047

0 1
 O   -1.414400      -1.414700      -1.231300    
 O   -2.937800      -1.499800      0.4550000    
 O    4.053800     -0.7305000     -0.2704000    
 N   -3.447000       1.182700     -1.7999999E-02
 N   0.6452000     -0.4690000      0.9939000    
 C   -1.097600       1.181400      0.6784000    
 C   -2.118300      0.6596000     -0.3421000    
 C   0.3051000      0.6884000      0.4032000    
 C    1.119600       1.438800     -0.4133000    
 C   -2.220500     -0.8519000     -0.2941000    
 C    2.403100      0.9572000     -0.6461000    
 C    2.808700     -0.2366000     -5.9700001E-02
 C    1.900200     -0.9056000      0.7446000    
 H   -1.376400      0.8606000       1.692000    
 H   -1.102900       2.279400      0.6972000    
 H   -1.862100      0.9770000      -1.359400    
 H   0.7902000       2.367000     -0.8662000    
 H   -3.726300      0.8811000      0.9147000    
 H   -4.137000      0.8058000     -0.6667000    
 H    3.081800       1.515100      -1.285100    
 H    2.157200      -1.842200       1.229400    
 H   -1.472900      -2.393800      -1.223600    
 H    4.147100      -1.565700      0.2194000    


%chk=000122047-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122047

0 1
O -1.489827 -1.504973 -1.264336
O -2.948031 -1.567913 0.545477
O 4.169086 -0.679875 -0.324761
N -3.486629 1.267730 -0.045368
N 0.688734 -0.489667 1.008918
C -1.138346 1.134712 0.720807
C -2.189593 0.631790 -0.322971
C 0.280647 0.685710 0.436774
C 1.147069 1.438582 -0.400650
C -2.266907 -0.905018 -0.267784
C 2.452761 0.979790 -0.658567
C 2.865547 -0.234990 -0.064742
C 1.950576 -0.934010 0.761250
H -1.439167 0.772521 1.720952
H -1.214563 2.235993 0.709857
H -1.853298 0.922222 -1.333021
H 0.798082 2.378721 -0.840883
H -3.892698 0.951456 0.844195
H -4.162301 1.175236 -0.811891
H 3.148427 1.534180 -1.294969
H 2.238514 -1.879297 1.244700
H -1.512550 -2.494698 -1.151894
H 4.353267 -1.533900 0.140708


