%chk=000073087.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073087

0 1
 O    2.158800       2.468400      0.8062000    
 O    4.168300      0.8154000       1.151000    
 O    4.327800      -2.221800     -0.5102000    
 N  -0.3555000      1.2200000E-02  2.6900001E-02
 N   -1.619100      -1.634300      0.8247000    
 N   -4.382200      0.5009000     -0.4117000    
 N   -4.617400      -1.613400      0.6758000    
 C   0.8548000      0.7659000     -0.3093000    
 C    1.755100       1.100900      0.8989000    
 C    2.966500      0.1553000      0.7989000    
 C    2.944100     -0.2839000     -0.6369000    
 C    1.781500      2.4400000E-02  -1.227000    
 C   -1.650300      0.3867000     -0.2266000    
 C    4.069500      -1.037600      -1.249700    
 C  -0.3895000      -1.201800      0.6559000    
 C   -2.418300     -0.6567000      0.2802000    
 C   -2.200100       1.507200     -0.8339000    
 C   -3.807400     -0.5781000      0.1754000    
 C   -3.586500       1.490100     -0.8886000    
 H   0.5375000       1.687900     -0.8083000    
 H    1.243300      0.9889000       1.860600    
 H    2.828500     -0.7140000       1.452300    
 H    1.530100     -0.2240000      -2.249100    
 H    4.976400     -0.4244000      -1.259400    
 H    3.841100      -1.322900      -2.282100    
 H   0.5025000      -1.726300      0.9698000    
 H    2.680100       2.572900     -8.0000004E-03
 H    4.885300      0.1593000       1.123500    
 H   -1.614700       2.324500      -1.231500    
 H   -4.122300       2.318400      -1.343600    
 H    5.074500      -2.671300     -0.9415000    
 H   -5.622000      -1.539000      0.5902000    
 H   -4.199100      -2.422400       1.114600    


%chk=000073087-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000073087

0 1
O 1.928247 2.421064 0.363883
O 3.937871 1.032215 1.127118
O 5.383178 -0.540388 -0.471745
N -0.405515 -0.238238 -0.464151
N -1.860850 -1.961333 -0.045503
N -4.386263 0.835113 0.217177
N -4.817247 -1.474349 0.469655
C 0.850923 0.500244 -0.715472
C 1.530036 1.044429 0.592001
C 2.804460 0.144452 0.809558
C 2.979399 -0.574458 -0.526659
C 1.920065 -0.373345 -1.351064
C -1.660815 0.358163 -0.263276
C 4.208068 -1.394223 -0.808243
C -0.587889 -1.624949 -0.311353
C -2.546348 -0.727968 -0.012237
C -2.114731 1.700943 -0.269289
C -3.927367 -0.451757 0.226465
C -3.494630 1.854621 -0.021338
H 0.601535 1.369564 -1.352303
H 0.833362 0.989631 1.449183
H 2.667447 -0.566526 1.648664
H 1.819037 -0.776287 -2.364335
H 4.251359 -1.702031 -1.870125
H 4.222511 -2.300548 -0.165356
H 0.233882 -2.329176 -0.416348
H 2.894884 2.461137 0.638619
H 4.742314 0.667944 0.645877
H -1.463765 2.563585 -0.431185
H -3.933851 2.858543 -0.005061
H 6.213349 -1.075799 -0.454173
H -5.793702 -1.246475 0.638441
H -4.487656 -2.436398 0.480074


