%chk=000084517.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000084517

0 1
 O  -0.2153000       1.896600     -0.2902000    
 N  -0.8294000     -0.3379000      7.8000002E-02
 N   -5.016000     -0.1728000      2.7500000E-02
 C    1.492300      0.3356000     -4.8799999E-02
 C    4.187300     -0.3809000      3.5000000E-02
 C    2.449200       1.266300      0.3559000    
 C    1.882900     -0.9534000     -0.4114000    
 C    3.796700      0.9081000      0.3979000    
 C    3.230400      -1.311700     -0.3694000    
 C   8.7399997E-02  0.7091000     -9.0899996E-02
 C   -2.244700     -0.2822000      6.0400002E-02
 C    5.627900     -0.7641000      7.9499997E-02
 C   -2.871400      0.9298000     -0.1448000    
 C   -2.969500      -1.440800      0.2496000    
 C   -4.257000      0.9314000     -0.1525000    
 C   -4.350800      -1.333200      0.2242000    
 H    2.165700       2.274100      0.6482000    
 H    1.180400      -1.700200     -0.7690000    
 H    4.532600       1.641100      0.7177000    
 H    3.523600      -2.316900     -0.6605000    
 H  -0.4663000      -1.266000      0.2772000    
 H    5.861100      -1.513200     -0.6849000    
 H    6.273100      0.1001000     -0.1121000    
 H    5.876700      -1.176300       1.062300    
 H   -2.383500       1.878600     -0.3003000    
 H   -2.495100      -2.402000      0.4120000    
 H   -4.811500       1.851100     -0.3087000    
 H   -4.978500      -2.206700      0.3664000    


%chk=000084517-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000084517

0 1
O -0.255097 1.948905 -0.103076
N -0.873468 -0.307732 0.090720
N -5.149295 -0.192254 -0.003199
C 1.507691 0.282751 -0.016060
C 4.290004 -0.397799 0.018173
C 2.486061 1.249951 0.329525
C 1.938052 -1.023816 -0.369439
C 3.852253 0.912311 0.349778
C 3.309033 -1.354148 -0.352592
C 0.070023 0.725788 -0.021740
C -2.285002 -0.215387 0.056467
C 5.760472 -0.767481 0.069378
C -2.997486 0.999266 -0.136215
C -3.036950 -1.411775 0.220916
C -4.407946 0.946774 -0.157770
C -4.443359 -1.348870 0.184016
H 2.147763 2.263167 0.569457
H 1.223390 -1.783323 -0.711572
H 4.592868 1.673272 0.622837
H 3.624492 -2.363178 -0.643313
H -0.500806 -1.245117 0.257245
H 6.003865 -1.569537 -0.649020
H 6.404874 0.100737 -0.153092
H 6.039499 -1.132856 1.076968
H -2.462109 1.941141 -0.257070
H -2.537591 -2.376384 0.374322
H -4.982192 1.868373 -0.305938
H -5.040739 -2.259179 0.308595


