%chk=000004909.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000004909

0 1
 O   -1.474300      -2.313500     -0.3835000    
 O   -1.535300       2.262600     -0.4939000    
 N   -1.486500      -1.169400       1.602100    
 N   -1.534600       1.208300       1.542000    
 C  -0.6261000     -1.1900000E-02 -0.4010000    
 C  -0.9206000     -4.6200000E-02  -1.916700    
 C   0.9084000      5.0000002E-04 -0.2344000    
 C   -1.243000      -1.281100      0.2449000    
 C   -1.284000       1.265500      0.1822000    
 C   -1.195000      4.4599999E-02   2.320000    
 C   -2.410700     -2.7500000E-02  -2.184700    
 C    1.600900      -1.202000     -0.1747000    
 C    1.578500       1.213800     -0.1465000    
 C    2.987500      -1.190800     -2.4300000E-02
 C    2.965200       1.224800      3.8000001E-03
 C    3.669600      2.2399999E-02  6.4800002E-02
 H  -0.4898000     -0.9448000      -2.378100    
 H  -0.4589000      0.8093000      -2.427400    
 H   -1.781500      5.6000002E-02   3.242400    
 H  -0.1286000      7.2099999E-02   2.561900    
 H   -1.846300      -1.973300       2.107000    
 H   -1.922600       2.023100       2.007100    
 H   -2.950600     -0.8516000      -1.712200    
 H   -2.899000      0.9045000      -1.891700    
 H   -2.576500     -0.1285000      -3.263900    
 H    1.108200      -2.164600     -0.2590000    
 H    1.067900       2.168900     -0.2062000    
 H    3.537100      -2.126700      1.8900000E-02
 H    3.497400       2.169300      6.9300003E-02
 H    4.749500      3.1099999E-02  0.1799000    


%chk=000004909-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000004909

0 1
O -1.509498 -2.356629 -0.363187
O -1.534643 2.332528 -0.432947
N -1.481042 -1.176839 1.628008
N -1.494154 1.212680 1.592353
C -0.684221 -0.007754 -0.412653
C -0.966620 -0.032369 -1.947182
C 0.858282 0.004515 -0.187614
C -1.266686 -1.284817 0.262268
C -1.280931 1.282239 0.223957
C -1.131933 0.031380 2.381182
C -2.459355 -0.044889 -2.337348
C 1.584748 -1.212259 -0.109872
C 1.571083 1.231291 -0.153373
C 2.991602 -1.200639 0.018261
C 2.977956 1.239856 -0.025219
C 3.694695 0.024785 0.063877
H -0.466962 -0.929681 -2.354644
H -0.474937 0.856418 -2.382105
H -1.690093 0.042517 3.332277
H -0.045421 0.040791 2.612908
H -1.843826 -2.000895 2.111463
H -1.865238 2.047066 2.051160
H -2.965679 -0.943848 -1.946338
H -2.974641 0.858578 -1.969068
H -2.554826 -0.059067 -3.438588
H 1.052868 -2.168921 -0.163662
H 1.028804 2.179556 -0.241327
H 3.537595 -2.149092 0.075871
H 3.513344 2.195783 -0.001637
H 4.786030 0.032618 0.161279


