%chk=000083658.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083658

0 1
 O    3.819200       1.401400      -1.122800    
 N   0.7540000      -1.274500      0.1915000    
 N   0.9359000      0.9373000      0.1077000    
 C    2.092600      -1.006500      0.2514000    
 C   9.9500000E-02 -7.7000000E-02  0.1058000    
 C    2.179800      0.3648000      0.1976000    
 C   -1.338700      5.7000001E-03  2.6300000E-02
 C    3.386700       1.206400      0.2246000    
 C    3.107300      -2.067400      0.3503000    
 C   -2.003600       1.114400      0.5500000    
 C   -2.064300      -1.022900     -0.5746000    
 C   -3.394000       1.194700      0.4726000    
 C   -3.454700     -0.9426000     -0.6520000    
 C   -4.119600      0.1661000     -0.1284000    
 H   0.3338000      -2.194300      0.2211000    
 H    3.172000       2.188100      0.6573000    
 H    4.201300      0.7512000      0.7961000    
 H    3.998400      -1.810900     -0.2316000    
 H    3.410000      -2.209000       1.392500    
 H    2.729000      -3.023000     -2.7300000E-02
 H   -1.457700       1.926000       1.025300    
 H   -1.576800      -1.894400      -1.004400    
 H   -3.911900       2.057600      0.8807000    
 H   -4.019800      -1.741900      -1.122600    
 H   -5.202200      0.2289000     -0.1892000    
 H    4.122400      0.5415000      -1.461800    


%chk=000083658-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000083658

0 1
O 3.304869 2.310583 -0.475457
N 0.827137 -1.459329 0.124046
N 1.064134 0.773340 0.119868
C 2.209761 -1.222022 0.202936
C 0.157566 -0.234187 0.069505
C 2.327961 0.173595 0.202991
C -1.297569 -0.079121 -0.027646
C 3.537822 1.073275 0.274649
C 3.228267 -2.321023 0.270456
C -1.848372 1.232149 -0.074435
C -2.180656 -1.193878 -0.077939
C -3.240850 1.419999 -0.169993
C -3.574967 -1.001326 -0.173365
C -4.112994 0.305624 -0.220210
H 0.393546 -2.380985 0.098542
H 3.770543 1.320391 1.333598
H 4.425627 0.584878 -0.165899
H 4.243415 -1.895524 0.208933
H 3.167573 -2.893134 1.216393
H 3.119899 -3.039855 -0.564085
H -1.162955 2.084254 -0.033712
H -1.793984 -2.220556 -0.043952
H -3.649218 2.436042 -0.205260
H -4.241689 -1.869991 -0.211348
H -5.195821 0.453428 -0.294398
H 2.319555 2.463072 -0.448116


