%chk=000117823.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000117823

0 1
 O   0.9586000     -7.9899997E-02  0.7709000    
 N    4.306100      0.3587000     -0.7019000    
 C  -0.3320000      9.8200001E-02  0.3720000    
 C   -1.123200     -0.9918000      9.3000000E-03
 C    1.970100      0.5650000     -3.9999999E-04
 C    3.247800     -0.2544000      8.6700000E-02
 C  -0.8602000       1.388500      0.3284000    
 C   -2.442400     -0.7917000     -0.3970000    
 C  -0.5746000      -2.379800      5.0000001E-02
 C   -2.179500       1.588600     -7.7600002E-02
 C   -2.970700      0.4986000     -0.4406000    
 H    1.656300      0.6551000      -1.049000    
 H    2.133300       1.571300      0.4037000    
 H    3.564900     -0.3393000       1.132100    
 H    3.061500      -1.275700     -0.2650000    
 H  -0.2593000       2.246900      0.6161000    
 H   -3.072100      -1.630000     -0.6829000    
 H   0.2778000      -2.471300     -0.6311000    
 H  -0.2512000      -2.631400       1.065500    
 H   -1.319600      -3.123700     -0.2519000    
 H   -2.591500       2.593000     -0.1096000    
 H   -3.998000      0.6546000     -0.7564000    
 H    4.024300      0.4041000      -1.680300    
 H    5.136500     -0.2312000     -0.6711000    


%chk=000117823-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000117823

0 1
O 0.993025 -0.526229 -0.074124
N 4.490358 0.724104 -0.260611
C -0.346434 -0.096036 -0.100552
C -1.316981 -1.137842 -0.003566
C 2.048796 0.494486 -0.172024
C 3.392390 -0.246286 -0.105800
C -0.734799 1.260658 -0.213925
C -2.680813 -0.770428 -0.023332
C -0.871504 -2.580662 0.118414
C -2.109274 1.593791 -0.230353
C -3.087109 0.581948 -0.135196
H 1.952991 1.046169 -1.131414
H 1.975067 1.218601 0.662469
H 3.479393 -0.727524 0.884527
H 3.386666 -1.062365 -0.862811
H 0.014080 2.054890 -0.286666
H -3.437168 -1.561351 0.050700
H -0.235696 -2.875315 -0.736696
H -0.258058 -2.732518 1.025912
H -1.739776 -3.260173 0.163295
H -2.407666 2.644677 -0.317040
H -4.152106 0.837034 -0.147368
H 4.653435 1.049970 -1.216165
H 5.354082 0.492802 0.232227


