%chk=000083311.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083311

0 1
 O   -2.810800      9.2000002E-03  0.1482000    
 O   -1.723700      -1.913400     -0.5008000    
 N    4.446300      -1.251500       1.266800    
 C    1.884300      0.3352000     -0.4872000    
 C  -0.5015000      0.1085000     -0.1801000    
 C   0.7328000     -0.4519000     -0.5087000    
 C    1.801400       1.682800     -0.1367000    
 C  -0.5844000       1.456200      0.1704000    
 C    3.204300     -0.2651000     -0.8366000    
 C   0.5672000       2.243200      0.1922000    
 C   -1.702100     -0.7118000     -0.2028000    
 C   -4.059500     -0.6911000      0.1644000    
 C   -5.157100      0.2678000      0.5733000    
 C    3.902800     -0.8181000      0.3377000    
 H   0.8060000      -1.502200     -0.7814000    
 H    2.690900       2.306800     -0.1144000    
 H   -1.523100       1.935400      0.4337000    
 H    3.839000      0.4883000      -1.319800    
 H    3.068100      -1.053300      -1.587800    
 H   0.5033000       3.292500      0.4655000    
 H   -4.266400      -1.088400     -0.8353000    
 H   -4.002900      -1.518500      0.8802000    
 H   -6.127700     -0.2355000      0.5963000    
 H   -4.952700      0.6875000       1.563800    
 H   -5.211800       1.110600     -0.1237000    


%chk=000083311-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083311

0 1
O -2.931036 0.060696 0.111624
O -1.880029 -1.831558 -0.753706
N 5.441646 0.761477 -0.259294
C 1.909653 0.127169 -0.263311
C -0.539851 0.092845 -0.071966
C 0.674461 -0.536825 -0.436606
C 1.920108 1.433605 0.281397
C -0.524014 1.402672 0.473232
C 3.192918 -0.604400 -0.678634
C 0.707636 2.064955 0.646419
C -1.807804 -0.668744 -0.280935
C -4.247796 -0.626902 -0.061282
C -5.319273 0.347824 0.414939
C 4.434604 0.150346 -0.445817
H 0.625796 -1.549980 -0.854073
H 2.872066 1.958181 0.421411
H -1.467725 1.878904 0.751755
H 3.143867 -0.861912 -1.755080
H 3.266940 -1.566318 -0.134267
H 0.730263 3.075954 1.066458
H -4.359760 -0.896033 -1.127130
H -4.229424 -1.561128 0.528633
H -6.317395 -0.114752 0.308615
H -5.170842 0.611037 1.476185
H -5.302311 1.276089 -0.181370


