%chk=000088923.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000088923

0 1
 O    3.527000      0.2011000     -0.3802000    
 O    2.606900      -1.728900      0.1177000    
 N   0.1038000     -0.5233000      0.3398000    
 N    1.047700       1.422700     -0.1641000    
 N    2.504100     -0.4832000     -8.2999997E-02
 C   -2.300400      4.2100001E-02  0.6574000    
 C  -0.8706000      0.4062000      0.3460000    
 C   -3.072100     -0.3353000     -0.6088000    
 C  -0.2990000       1.590600      4.0199999E-02
 C   -4.505000     -0.7309000     -0.2893000    
 C    1.257600      0.1388000      2.4400000E-02
 H   -2.319300     -0.7903000       1.372100    
 H   -2.786300      0.8937000       1.149900    
 H   -3.077400      0.5073000      -1.311100    
 H   -2.574700      -1.169500      -1.118600    
 H   9.3999999E-03  -1.513200      0.5282000    
 H  -0.7623000       2.562200     -4.9699999E-02
 H   -4.532900      -1.596000      0.3810000    
 H   -5.041700      9.3800001E-02  0.1904000    
 H   -5.039000     -0.9953000      -1.207400    


%chk=000088923-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000088923

0 1
O 3.611008 0.078643 -0.389208
O 2.347707 -1.838716 -0.238148
N 0.090202 -0.456583 0.200078
N 1.148909 1.552151 0.092412
N 2.498658 -0.537422 -0.218255
C -2.345961 0.175890 0.629665
C -0.897763 0.502862 0.404890
C -3.031489 -0.519046 -0.583016
C -0.209319 1.738126 0.333237
C -4.520169 -0.815485 -0.308311
C 1.292264 0.216358 0.017537
H -2.458710 -0.472425 1.522716
H -2.879188 1.116574 0.857824
H -2.930944 0.127843 -1.475211
H -2.502240 -1.464065 -0.818965
H 0.004565 -1.474264 0.178076
H -0.626677 2.736688 0.442760
H -4.641686 -1.483712 0.564836
H -5.079933 0.115449 -0.100835
H -4.993432 -1.306267 -1.177182


