%chk=000078529.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000078529

0 1
 O  -0.6830000      0.3256000      -1.408700    
 N  -0.5325000      0.2477000     -4.7200002E-02
 C  -4.2800002E-02  -1.130900      0.3498000    
 C   0.4537000       1.293600      0.4337000    
 C    1.355800      -1.417600     -0.1828000    
 C    1.859600       1.043100     -9.7900003E-02
 C    2.349000     -0.3532000      0.2711000    
 C   -1.873600      0.5004000      0.5853000    
 C   -2.886300     -0.5088000      9.6699998E-02
 H  -0.7324000      -1.865800     -7.3700003E-02
 H  -7.0500001E-02  -1.176400       1.444200    
 H   0.4348000       1.262500       1.529200    
 H   7.2899997E-02   2.261700      8.9699998E-02
 H    1.338400      -1.452200      -1.278800    
 H    1.687300      -2.403000      0.1632000    
 H    2.546000       1.794300      0.3080000    
 H    1.871200       1.154500      -1.188800    
 H    2.485200     -0.4186000       1.357600    
 H    3.327200     -0.5376000     -0.1866000    
 H   -1.747300      0.4585000       1.672200    
 H   -2.164900       1.514400      0.2884000    
 H   -3.889400     -0.1880000      0.3992000    
 H   -2.896800     -0.6228000     -0.9911000    
 H   -2.733900      -1.495100      0.5453000    


%chk=000078529-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000078529

0 1
O -0.607282 0.241008 -1.441974
N -0.517482 0.192312 -0.019013
C 0.013294 -1.185751 0.435262
C 0.457098 1.281118 0.479677
C 1.400549 -1.433332 -0.172743
C 1.849337 1.058278 -0.123975
C 2.405831 -0.336277 0.246573
C -1.905469 0.468148 0.608669
C -2.978949 -0.464789 0.044937
H -0.714998 -1.923509 0.065924
H 0.038870 -1.205162 1.543892
H 0.480440 1.252770 1.588485
H 0.024613 2.236318 0.139874
H 1.279239 -1.431380 -1.271130
H 1.751512 -2.435981 0.137546
H 2.523510 1.862070 0.228242
H 1.748396 1.143640 -1.220799
H 2.588872 -0.390980 1.340801
H 3.379114 -0.502089 -0.251609
H -1.814372 0.401553 1.711161
H -2.126375 1.511006 0.324382
H -3.981333 -0.067428 0.283331
H -2.850411 -0.495924 -1.051317
H -2.916305 -1.489318 0.451803


