%chk=000060292.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000060292

0 1
 O   -2.367000      -1.576100      -1.874400    
 O   -1.303300      9.5700003E-02   2.382700    
 O   -3.616100       2.662300     -0.6372000    
 N    2.434800      0.3130000      0.1155000    
 N   -2.903800      0.5760000      -1.289400    
 N   -2.372000       1.411500      0.8369000    
 C   -1.265300     -0.6405000      7.2600000E-02
 C   9.5700003E-02 -0.1555000     -0.4582000    
 C    1.157400     -0.1710000      0.6386000    
 C    2.909800     -0.5585000     -0.9684000    
 C    3.428600      0.4093000       1.193800    
 C    4.220700     -3.8500000E-02  -1.560400    
 C    4.756500      0.9607000      0.6727000    
 C    5.288700      0.1236000     -0.4849000    
 C   -1.122000      -2.075400      0.6003000    
 C   -2.235100     -0.6248000      -1.104800    
 C   -1.654200      0.2878000       1.218800    
 C   -2.460900      -2.628900       1.033200    
 C   -2.992600       1.629300     -0.3873000    
 H   8.8999998E-03  0.8593000     -0.8704000    
 H   0.3556000     -0.8102000      -1.296100    
 H    1.300200      -1.170700       1.059900    
 H   0.8691000      0.5005000       1.452100    
 H    3.045300      -1.589400     -0.6160000    
 H    2.217900     -0.5842000      -1.813400    
 H    3.065200       1.085400       1.977400    
 H    3.595900     -0.5705000       1.660600    
 H    4.046300      0.9282000      -2.050000    
 H    4.578400     -0.7282000      -2.333400    
 H    5.493200      0.9803000       1.483800    
 H    4.618700       1.997700      0.3407000    
 H    5.588400     -0.8645000     -0.1146000    
 H    6.182500      0.5935000     -0.9095000    
 H  -0.4633000      -2.135400       1.472800    
 H  -0.6953000      -2.735000     -0.1657000    
 H   -2.935000      -2.016800       1.806400    
 H   -3.167300      -2.738400      0.2061000    
 H   -2.321300      -3.629100       1.458900    
 H   -3.451600      0.6645000      -2.140700    
 H   -2.527700       2.115700       1.552800    


%chk=000060292-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000060292

0 1
O -2.276354 -1.476762 -2.007107
O -1.199040 0.265532 2.384637
O -3.797383 2.684188 -0.606598
N 2.535944 0.105396 0.069016
N -2.975309 0.603634 -1.288825
N -2.413801 1.468305 0.835069
C -1.315336 -0.673529 0.110118
C 0.134724 -0.344224 -0.448263
C 1.288071 -0.525262 0.565724
C 3.163344 -0.659291 -1.041872
C 3.504479 0.345038 1.173232
C 4.394610 0.078379 -1.606833
C 4.740530 1.119535 0.672177
C 5.423324 0.365546 -0.490553
C -1.376520 -2.117374 0.694322
C -2.228673 -0.579401 -1.127020
C -1.638770 0.351450 1.207885
C -2.784596 -2.546451 1.155920
C -3.104882 1.663244 -0.373739
H 0.169276 0.702105 -0.809690
H 0.274896 -1.004891 -1.323896
H 1.437775 -1.612047 0.784412
H 1.017538 -0.038339 1.519524
H 3.474267 -1.680970 -0.691763
H 2.417662 -0.802145 -1.844722
H 2.989364 0.920275 1.965111
H 3.842946 -0.623378 1.630574
H 4.061971 1.033451 -2.057524
H 4.848345 -0.532202 -2.411120
H 5.446086 1.266585 1.512490
H 4.416797 2.120080 0.325615
H 5.837313 -0.593504 -0.115140
H 6.273694 0.951481 -0.887452
H -0.681746 -2.166130 1.549939
H -1.010572 -2.807321 -0.087404
H -3.165032 -1.889235 1.959559
H -3.507400 -2.541983 0.319947
H -2.754501 -3.574313 1.559193
H -3.513170 0.699290 -2.156664
H -2.545870 2.197937 1.543522


