%chk=000004763.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004763

0 1
 O   0.5804000     -0.5584000      -2.424300    
 O   0.5748000     -0.7675000       2.364800    
 O    3.408800       2.022600      9.0700001E-02
 N    1.953800      0.7435000      -1.139400    
 N    1.949000      0.6435000       1.201600    
 C   0.2257000     -0.6356000     -2.8899999E-02
 C   0.1297000      -2.166300     -9.5500000E-02
 C   -1.164300     -6.4599998E-02 -6.2000002E-03
 C   0.9283000     -0.1696000      -1.307400    
 C   0.9247000     -0.2821000       1.286800    
 C    1.504400      -2.799600     -8.7700002E-02
 C   -1.340100       1.313400     -2.1700000E-02
 C   -2.257500     -0.9212000      2.9500000E-02
 C    2.493800       1.198000      5.3599998E-02
 C   -2.630100       1.843500     -8.9999998E-04
 C   -3.547500     -0.3909000      5.0099999E-02
 C   -3.733700      0.9915000      3.4899998E-02
 H  -0.3795000      -2.514000      -1.004800    
 H  -0.3914000      -2.590100      0.7739000    
 H    2.112400      -2.490700     -0.9435000    
 H    2.064200      -2.582700      0.8269000    
 H    1.405400      -3.889600     -0.1462000    
 H    2.380900       1.100600      -1.989700    
 H    2.373000      0.9262000       2.080800    
 H  -0.4965000       1.996500     -4.6300001E-02
 H   -2.212400      -2.002500      4.0500000E-02
 H   -2.775300       2.919800     -1.1800000E-02
 H   -4.408200      -1.052900      7.7399999E-02
 H   -4.738200       1.404200      5.1100001E-02


%chk=000004763-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000004763

0 1
O 0.660680 -0.656413 -2.451389
O 0.635372 -0.831434 2.404719
O 3.272865 2.215448 0.097246
N 1.893270 0.794096 -1.143916
N 1.875673 0.714439 1.218979
C 0.236149 -0.742805 -0.025634
C 0.219083 -2.301624 -0.081566
C -1.191416 -0.110239 -0.006760
C 0.932667 -0.224724 -1.304646
C 0.918693 -0.316910 1.295485
C 1.624624 -2.935918 -0.117434
C -1.327200 1.303377 -0.011045
C -2.360491 -0.906408 0.020783
C 2.403512 1.310445 0.060340
C -2.602129 1.905969 0.010405
C -3.637848 -0.302158 0.042150
C -3.765371 1.103896 0.037280
H -0.343097 -2.598176 -0.984326
H -0.322224 -2.663145 0.810063
H 2.194101 -2.623773 -1.011573
H 2.212531 -2.683747 0.783883
H 1.538489 -4.035962 -0.152997
H 2.303969 1.180927 -2.000378
H 2.271692 1.044016 2.105683
H -0.441116 1.948601 -0.033775
H -2.291318 -1.996629 0.024793
H -2.687029 2.998031 0.005642
H -4.532804 -0.933517 0.062534
H -4.756724 1.569338 0.053755


