%chk=000069396.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000069396

0 1
 O   -2.331400     -0.8253000     -0.8551000    
 O   -2.550800      0.9642000      0.4114000    
 N   -1.923300     -3.0700000E-02  9.2000002E-03
 C    1.878300      0.1758000      0.2895000    
 C   0.4424000      0.4320000     -0.2037000    
 C  -0.6083000     -0.2974000      0.6189000    
 C    2.170400      -1.326700      0.2845000    
 C    2.922600      0.9080000     -0.5546000    
 H    1.965400      0.5394000       1.321300    
 H   0.2468000       1.512400     -0.1798000    
 H   0.3652000      0.1343000      -1.258500    
 H  -0.4861000      -1.383800      0.6163000    
 H  -0.6383000      5.5399999E-02   1.654600    
 H    1.595000      -1.855200       1.050200    
 H    1.949700      -1.775600     -0.6899000    
 H    3.227100      -1.514200      0.5061000    
 H    3.931100      0.7404000     -0.1619000    
 H    2.901100      0.5669000      -1.595200    
 H    2.735500       1.986800     -0.5481000    


%chk=000069396-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000069396

0 1
O -2.531238 -0.691904 -0.837484
O -2.556871 1.130169 0.540348
N -2.015033 0.059945 0.071666
C 1.883415 0.130860 0.288911
C 0.452133 0.361296 -0.269361
C -0.635151 -0.315480 0.593445
C 2.274762 -1.366476 0.314395
C 2.899688 0.944649 -0.547802
H 1.909779 0.516426 1.330530
H 0.249308 1.448901 -0.305557
H 0.392133 -0.026937 -1.304766
H -0.576503 -1.412871 0.543354
H -0.591907 0.034872 1.637353
H 1.627164 -1.961314 0.984514
H 2.210700 -1.805107 -0.700145
H 3.314651 -1.489471 0.667924
H 3.921751 0.833707 -0.142059
H 2.913519 0.593680 -1.597380
H 2.650102 2.021757 -0.552688


