%chk=000154446.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000154446

0 1
 O   0.8284000      -2.360100     -0.7739000    
 N    2.212900      0.1001000     -0.3594000    
 N    2.233000       1.310900     -7.9700001E-02
 N    2.254200       2.424200      0.1673000    
 C   0.6003000      -1.581500      0.4085000    
 C  -0.5719000     -0.6858000      0.1879000    
 C    1.880400     -0.8030000      0.7477000    
 C   -1.391600     -0.3331000       1.259900    
 C  -0.8484000     -0.2011000      -1.090400    
 C   -2.488100      0.5041000       1.053600    
 C   -1.944700      0.6363000      -1.296800    
 C   -2.764500      0.9889000     -0.2247000    
 H   0.3900000      -2.294600       1.214600    
 H    2.713100      -1.505600      0.8661000    
 H    1.761400     -0.2630000       1.696100    
 H   -1.185500     -0.7026000       2.260900    
 H  -0.2237000     -0.4509000      -1.943600    
 H   -3.126000      0.7793000       1.888300    
 H   -2.159000       1.015700      -2.291600    
 H   -3.617700       1.641500     -0.3852000    
 H   2.5000000E-02  -2.881700     -0.9442000    


%chk=000154446-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000154446

0 1
O 0.891770 -2.515275 -0.674442
N 2.339400 0.136158 -0.274466
N 1.959306 1.334078 -0.114916
N 1.732151 2.500854 -0.143863
C 0.622034 -1.623477 0.463832
C -0.559417 -0.693920 0.215848
C 1.963879 -0.893514 0.740300
C -1.441620 -0.361309 1.273820
C -0.781378 -0.143785 -1.073165
C -2.521980 0.522341 1.054393
C -1.862781 0.737626 -1.292223
C -2.733882 1.074960 -0.229906
H 0.417324 -2.231997 1.374734
H 2.762682 -1.651800 0.699076
H 1.928869 -0.456998 1.757546
H -1.286374 -0.795542 2.270076
H -0.095478 -0.400522 -1.887680
H -3.198004 0.774815 1.878838
H -2.022540 1.166130 -2.287861
H -3.570897 1.760841 -0.401163
H 0.034535 -2.901663 -0.987377


