%chk=000085447.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000085447

0 1
 N   0.6290000     -0.6991000      4.1999999E-02
 C    1.912000     -1.1900000E-02  6.9999998E-04
 C  -0.4733000      0.2539000     -7.4000000E-03
 C   -1.812300     -0.4811000      2.6000001E-02
 C    3.029200      -1.059600      4.6500001E-02
 C    1.995000      0.7885000      -1.303400    
 C    2.023500      0.9302000       1.205200    
 C   -2.983200      0.5020000     -3.4000000E-03
 C   -4.319700     -0.2229000     -6.2000002E-03
 H   0.5572000      -1.261500      0.8897000    
 H  -0.4695000      0.8453000     -0.9275000    
 H  -0.4675000      0.9386000      0.8461000    
 H   -1.878900      -1.097100      0.9319000    
 H   -1.882800      -1.161300     -0.8324000    
 H    2.960800      -1.753300     -0.7998000    
 H    4.017200     -0.5870000      6.0000001E-03
 H    2.985200      -1.652000      0.9681000    
 H    1.383400       1.696900      -1.301600    
 H    1.716100      0.1809000      -2.172800    
 H    3.025400       1.126000      -1.472900    
 H    1.776700      0.4207000       2.144300    
 H    3.053800       1.294500       1.304400    
 H    1.398400       1.825300       1.121200    
 H   -2.918000       1.134200     -0.8966000    
 H   -2.935500       1.165400      0.8680000    
 H   -5.142300      0.4988000     -2.6200000E-02
 H   -4.413700     -0.8694000     -0.8845000    
 H   -4.432100     -0.8415000      0.8898000    


%chk=000085447-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000085447

0 1
N 0.601005 -0.534055 0.040187
C 1.980423 0.050496 0.012911
C -0.564465 0.378396 0.019333
C -1.878395 -0.430112 0.013151
C 2.958643 -1.149328 0.058652
C 2.182889 0.823210 -1.314767
C 2.265650 0.996081 1.220338
C -3.138242 0.464952 -0.005660
C -4.449880 -0.349723 -0.012693
H 0.518049 -1.206644 0.818033
H -0.517314 0.989150 -0.902329
H -0.589958 1.094734 0.879055
H -1.911848 -1.085466 0.910500
H -1.875633 -1.102605 -0.866690
H 2.783848 -1.814344 -0.805088
H 4.008014 -0.803708 0.038647
H 2.814913 -1.740998 0.984227
H 1.563203 1.737509 -1.358250
H 1.913332 0.178667 -2.169916
H 3.239011 1.131756 -1.420180
H 2.164822 0.449502 2.177740
H 3.291656 1.406363 1.168010
H 1.564163 1.850636 1.236947
H -3.105134 1.121304 -0.899269
H -3.124649 1.138662 0.875572
H -5.337018 0.309697 -0.033695
H -4.498805 -1.012175 -0.897348
H -4.524183 -0.988457 0.887783


