%chk=000060506.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060506

0 1
 O    1.703900     -0.8191000      -1.569200    
 O    1.791700      0.7979000       1.518200    
 N   -1.798700       1.609400     -0.7621000    
 N   -1.777600      -1.608200      0.8008000    
 C   7.1000000E-03  2.7999999E-03  2.4000001E-03
 C  -0.8588000       1.265400      0.3020000    
 C  -0.8590000      -1.262300     -0.2810000    
 C   0.8819000      0.2966000      -1.247900    
 C   0.9096000     -0.2824000       1.236600    
 H  -0.2145000       2.138100      0.4580000    
 H   -1.422100       1.132400       1.232600    
 H  -0.2047000      -2.127200     -0.4435000    
 H   -1.433600      -1.136600      -1.205800    
 H    1.524000       1.172300      -1.103100    
 H   0.2640000      0.4836000      -2.131100    
 H    1.523000      -1.175600       1.078500    
 H   0.3114000     -0.4631000       2.136900    
 H   -2.416900      0.8240000     -0.9551000    
 H   -1.302400       1.810400      -1.627200    
 H   -2.297900      -2.446600      0.5448000    
 H   -2.471300     -0.8704000      0.9123000    
 H    2.417800     -0.8592000     -0.9111000    
 H    1.268300       1.511200       1.920300    


%chk=000060506-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060506

0 1
O 2.006410 -0.645097 -1.282560
O 2.070407 0.408238 1.275113
N -1.742358 1.795662 -0.851143
N -1.719081 -1.739245 0.838082
C -0.077854 -0.016272 -0.010900
C -0.963482 1.246472 0.270075
C -0.957023 -1.258083 -0.331354
C 0.854424 0.257116 -1.230989
C 0.780322 -0.334295 1.247275
H -0.312385 2.063057 0.648921
H -1.661640 1.009931 1.097735
H -0.275342 -2.064998 -0.660200
H -1.602941 -1.015298 -1.210491
H 1.191128 1.318621 -1.218676
H 0.308614 0.085097 -2.175498
H 1.083956 -1.391669 1.247122
H 0.209934 -0.144670 2.174898
H -2.478978 1.189120 -1.219150
H -1.195694 2.245298 -1.589116
H -1.857851 -2.750702 0.878714
H -2.576032 -1.222133 1.048461
H 2.558189 -0.410787 -0.484400
H 1.902475 1.368037 1.444381


