%chk=000052052.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052052

0 1
 I    1.653600      -2.785900      -1.456700    
 O  -0.4723000      -1.940300       1.233700    
 N  -9.9799998E-02  8.6800002E-02  0.1701000    
 C   -1.449600      0.5653000      0.4420000    
 C   0.7759000       1.040400     -0.5050000    
 C   -2.429600      0.1989000     -0.6660000    
 C    1.491500       1.964500      0.4731000    
 C   0.2805000      -1.181700      0.6126000    
 C   -3.837100      0.7137000     -0.4004000    
 C    2.390100       2.976200     -0.2238000    
 C    1.696700      -1.637900      0.3204000    
 H   -1.425900       1.650700      0.5932000    
 H   -1.796200      0.1257000       1.385100    
 H   0.1708000       1.627900      -1.206400    
 H    1.508100      0.5088000      -1.118300    
 H   -2.077900      0.6042000      -1.622300    
 H   -2.463400     -0.8908000     -0.7856000    
 H   0.7574000       2.506700       1.080700    
 H    2.093700       1.375500       1.174600    
 H   -3.844600       1.805200     -0.3181000    
 H   -4.506200      0.4288000      -1.218300    
 H   -4.236900      0.2955000      0.5287000    
 H    1.810500       3.613100     -0.8995000    
 H    2.881300       3.619100      0.5133000    
 H    3.166400       2.471500     -0.8073000    
 H    2.406800     -0.8117000      0.2693000    
 H    2.023300      -2.258300       1.163400    


%chk=000052052-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052052

0 1
I 1.941027 -2.482605 -1.652409
O -0.593465 -1.933153 1.247410
N -0.105159 0.105567 0.229631
C -1.494390 0.566485 0.476471
C 0.809352 1.035404 -0.468789
C -2.458456 0.179120 -0.669409
C 1.554284 2.002262 0.484071
C 0.233212 -1.172395 0.646112
C -3.889577 0.692680 -0.406525
C 2.437854 3.002254 -0.291388
C 1.658863 -1.658527 0.402551
H -1.475543 1.665283 0.608352
H -1.844120 0.107842 1.417577
H 0.205646 1.624466 -1.186293
H 1.534321 0.465016 -1.076528
H -2.080193 0.587716 -1.627607
H -2.460949 -0.922139 -0.764674
H 0.813967 2.548777 1.100184
H 2.174930 1.416005 1.189985
H -3.914233 1.795867 -0.322607
H -4.571177 0.402369 -1.225677
H -4.295298 0.272634 0.532499
H 1.831921 3.624082 -0.976793
H 2.967979 3.682218 0.398501
H 3.199111 2.477808 -0.898684
H 2.441186 -0.893398 0.510127
H 1.846007 -2.519737 1.056412


