%chk=000071831.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000071831

1 1
 O    1.204800      -1.373000      -1.536600    
 N    1.890500      0.2537000     -4.1000000E-03
 N   -2.611200      0.3947000     -0.3303000    
 C    3.294500      0.2480000     -0.3904000    
 C    1.533200       1.178500       1.069500    
 C   0.9391000     -0.5777000     -0.6245000    
 C  -0.4410000     -0.5276000     -0.1734000    
 C    4.087400     -0.7604000      0.4151000    
 C    1.139500       2.535800      0.5246000    
 C   -1.340300      0.3557000     -0.7534000    
 C  -0.8856000      -1.363200      0.8468000    
 C   -3.065500     -0.3982000      0.6496000    
 C   -2.211100      -1.301300       1.265900    
 C   -3.534300       1.335200     -0.9589000    
 H    3.361100     -1.8200001E-02  -1.451300    
 H    3.712100       1.254200     -0.2788000    
 H   0.7121000      0.7757000       1.668100    
 H    2.386600       1.279800       1.749800    
 H    4.057800     -0.5268000       1.484300    
 H    3.687400      -1.771500      0.2852000    
 H    5.134300     -0.7643000      9.6500002E-02
 H    1.968100       2.993200     -2.6200000E-02
 H   0.2876000       2.483300     -0.1559000    
 H   0.8725000       3.208400       1.345900    
 H   -1.067300       1.032000      -1.555000    
 H  -0.2067000      -2.066000       1.322600    
 H   -4.105800     -0.2990000      0.9354000    
 H   -2.569500      -1.946100       2.061200    
 H   -3.274800       1.448000      -2.015300    
 H   -4.557300      0.9559000     -0.8865000    
 H   -3.441300       2.290300     -0.4351000    


%chk=000071831-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000071831

1 1
O 0.984805 -0.541937 -1.741903
N 1.921147 0.443169 0.165680
N -2.881288 0.124210 -0.554460
C 3.290857 0.278675 -0.414196
C 1.799361 1.270374 1.397411
C 0.872595 -0.047806 -0.566430
C -0.533408 -0.084322 0.008700
C 3.896663 -1.096133 -0.069421
C 1.924136 2.783099 1.114234
C -1.562009 0.293066 -0.880114
C -0.896953 -0.686614 1.239353
C -3.247507 -0.456998 0.644259
C -2.265231 -0.878910 1.546301
C -3.952659 0.548271 -1.511151
H 3.216090 0.394306 -1.508973
H 3.918984 1.095868 -0.021292
H 0.830388 1.072156 1.883952
H 2.588631 0.946340 2.100193
H 3.973606 -1.245649 1.022452
H 3.289471 -1.909931 -0.500359
H 4.913121 -1.170806 -0.494170
H 2.889322 3.032655 0.641305
H 1.115912 3.133557 0.448092
H 1.860820 3.346346 2.062041
H -1.328585 0.692407 -1.869506
H -0.128113 -1.034270 1.935625
H -4.317131 -0.571459 0.830416
H -2.573607 -1.356699 2.478918
H -3.491794 0.960382 -2.419855
H -4.568260 -0.323884 -1.781723
H -4.582465 1.319637 -1.040578


