%chk=000052274.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000052274

0 1
 O   -4.927800      -1.052600     -0.1962000    
 O   -5.663500      0.9463000      0.6769000    
 N   5.2900001E-02 -0.8127000      0.2277000    
 N   0.6533000       1.847600     -0.2148000    
 C    1.406900     -0.4355000      0.1173000    
 C    1.713900      0.9248000     -0.1088000    
 C   -1.008700      0.1086000      0.1218000    
 C  -0.7009000       1.472300     -0.1050000    
 C    3.780200     -0.9740000      0.1126000    
 C    4.088100      0.3902000     -0.1138000    
 C    2.437800      -1.372200      0.2259000    
 C    3.047000       1.327100     -0.2222000    
 C   -2.341500     -0.2932000      0.2345000    
 C   -1.731800       2.408000     -0.2150000    
 C   -3.363200      0.6506000      0.1231000    
 C   -3.059800       1.994900     -0.1007000    
 C    4.826500      -1.904300      0.2196000    
 C    5.432600      0.7802000     -0.2255000    
 C    6.156300      -1.498200      0.1060000    
 C    6.458800     -0.1585000     -0.1163000    
 C   -4.751300      0.2323000      0.2397000    
 C   -6.257100      -1.580400     -0.1327000    
 C   -6.248800      -3.001600     -0.6540000    
 H  -0.1661000      -1.786500      0.3898000    
 H   0.8735000       2.821300     -0.3761000    
 H    2.192600      -2.418600      0.4000000    
 H    3.275200       2.377400     -0.3962000    
 H   -2.561600      -1.341700      0.4208000    
 H   -1.510500       3.457400     -0.3899000    
 H   -3.850000       2.736100     -0.1920000    
 H    4.614400      -2.957300      0.3933000    
 H    5.693300       1.822200     -0.3994000    
 H    6.955500      -2.228800      0.1910000    
 H    7.494200      0.1573000     -0.2049000    
 H   -6.603800      -1.567700      0.9065000    
 H   -6.922900     -0.9634000     -0.7459000    
 H   -7.251300      -3.436900     -0.6193000    
 H   -5.885800      -3.031000      -1.686800    
 H   -5.571400      -3.625300     -6.1400000E-02


%chk=000052274-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000052274

0 1
O -4.980558 -1.119075 -0.128021
O -5.791802 1.069919 -0.141237
N 0.066907 -0.820490 -0.052532
N 0.677451 1.878745 -0.055763
C 1.426603 -0.454411 -0.035126
C 1.749123 0.958566 -0.037037
C -0.995291 0.107482 -0.071556
C -0.673629 1.503954 -0.072689
C 3.834902 -0.995660 0.000877
C 4.155289 0.416726 -0.001435
C 2.455440 -1.394837 -0.016295
C 3.079888 1.369009 -0.020617
C -2.339448 -0.297723 -0.089076
C -1.715749 2.459000 -0.090508
C -3.384297 0.668395 -0.107269
C -3.062531 2.047913 -0.107624
C 4.902406 -1.947374 0.019983
C 5.527643 0.817879 0.015317
C 6.239081 -1.527752 0.036136
C 6.554422 -0.135493 0.033785
C -4.813652 0.277064 -0.126712
C -6.393446 -1.598008 -0.148064
C -6.342373 -3.122687 -0.137454
H -0.163873 -1.813591 -0.052061
H 0.901954 2.873848 -0.056475
H 2.214094 -2.465254 -0.014559
H 3.319953 2.439927 -0.022126
H -2.601154 -1.360394 -0.088967
H -1.467464 3.526940 -0.090921
H -3.876968 2.778163 -0.121314
H 4.661095 -3.017264 0.021785
H 5.769270 1.887790 0.013519
H 7.047424 -2.267064 0.050641
H 7.602176 0.184146 0.046524
H -6.915256 -1.185289 0.734432
H -6.885385 -1.197258 -1.053027
H -7.368930 -3.532413 -0.154054
H -5.802467 -3.505163 -1.020761
H -5.835646 -3.494066 0.769882


