%chk=000139570.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000139570

0 1
 O   8.4299996E-02   1.766800       1.285300    
 O    4.232300       1.140800     -0.8165000    
 O   -4.229200     -0.4165000     -0.8585000    
 N  -0.3468000      -1.156100      0.8180000    
 N    2.833200     -0.7032000     -0.5791000    
 N    2.166800       1.478100      0.2359000    
 N    1.154600      -2.460200     -0.1898000    
 N   -2.730400      0.9340000      0.1143000    
 N   -3.457400      -1.231000     -2.0300001E-02
 C   0.7102000     -0.3504000      0.5047000    
 C    1.613800      -1.172900     -0.1108000    
 C   -1.572000     -0.7800000       1.481800    
 C   0.9080000       1.044500      0.7309000    
 C    3.161900      0.6664000     -0.4195000    
 C  -3.2099999E-02  -2.416500      0.3799000    
 C    3.763600      -1.618400      -1.228300    
 C   -2.622900     -0.3516000      0.4935000    
 C    2.485800       2.891400      0.4086000    
 C   -3.735100      0.8417000     -0.7198000    
 C   -4.388600       1.893100      -1.510400    
 H   -1.363300      1.2500000E-02   2.205700    
 H   -1.919800      -1.646900       2.056800    
 H  -0.7018000      -3.257200      0.5014000    
 H    4.676700      -1.106700      -1.542700    
 H    3.280200      -2.051100      -2.109600    
 H    4.029000      -2.413900     -0.5251000    
 H    1.690600       3.448000      0.9094000    
 H    2.668700       3.331000     -0.5771000    
 H    3.407100       2.972000      0.9944000    
 H   -4.316100       1.672000      -2.579400    
 H   -5.446600       1.973700      -1.243700    
 H   -3.916800       2.863700      -1.330400    


%chk=000139570-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000139570

0 1
O 0.613078 1.896285 1.831546
O 4.545442 1.021774 -0.624180
O -4.826731 -0.471115 -0.128583
N -0.397246 -0.843159 0.734839
N 2.852175 -0.602034 -0.697532
N 2.574319 1.436626 0.576237
N 0.910697 -2.143527 -0.616730
N -2.887111 0.683889 -0.411755
N -3.894171 -0.953926 0.903091
C 0.804888 -0.145247 0.541353
C 1.579849 -0.969091 -0.288784
C -1.557789 -0.362672 1.517356
C 1.257011 1.122699 1.052122
C 3.394509 0.635376 -0.275708
C -0.283548 -2.026593 0.020857
C 3.643745 -1.489498 -1.572514
C -2.786242 -0.217447 0.663859
C 3.175930 2.721007 1.004754
C -4.124679 0.507369 -0.867212
C -4.831876 1.177126 -1.992402
H -1.268534 0.616836 1.940272
H -1.770237 -1.061078 2.344207
H -1.077598 -2.768632 -0.016738
H 4.606767 -0.994753 -1.763951
H 3.107261 -1.661326 -2.520484
H 3.805066 -2.461660 -1.077604
H 2.442391 3.228379 1.647909
H 3.412034 3.338697 0.123188
H 4.111548 2.534483 1.556588
H -5.157146 0.440887 -2.747984
H -5.732625 1.704612 -1.632898
H -4.153278 1.902815 -2.463516


