%chk=000058291.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000058291

0 1
 O    4.384200     -0.1754000     -0.6389000    
 N   -4.273200     -0.3559000     -0.1649000    
 N   -1.904400     -6.6000000E-03  8.1500001E-02
 C   0.4578000      0.5503000      0.4498000    
 C  -0.9684000      0.8137000      0.8450000    
 C    1.035000       1.295100     -0.5702000    
 C    1.180900     -0.4351000       1.109700    
 C    3.093100      6.3000001E-02 -0.2804000    
 C    2.358400       1.050400     -0.9371000    
 C    2.504300     -0.6798000      0.7430000    
 C   -3.140100      0.2332000      0.3667000    
 C   -5.603400      3.7599999E-02  0.2778000    
 C   -4.201700      -1.191500      -1.355500    
 C    5.077600      -1.199000      7.3600002E-02
 H   -1.082900      0.6194000       1.920300    
 H   -1.186300       1.881000      0.7008000    
 H   0.4713000       2.065000      -1.089600    
 H   0.7301000      -1.020300       1.906500    
 H    2.811500       1.631700      -1.735400    
 H    3.016600      -1.461300       1.293700    
 H   -3.401900      0.9805000       1.138500    
 H   -6.324900     -0.7747000      0.1409000    
 H   -5.946000      0.9078000     -0.2908000    
 H   -5.603800      0.2954000       1.342400    
 H   -3.331400      -1.855200      -1.316800    
 H   -4.123200     -0.5646000      -2.249400    
 H   -5.088700      -1.825700      -1.455700    
 H    6.089400      -1.252900     -0.3413000    
 H    4.616000      -2.180200     -8.1000000E-02
 H    5.180200     -0.9511000       1.135500    


%chk=000058291-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000058291

0 1
O 4.106205 -0.349536 -1.103321
N -4.237325 0.197778 -0.285585
N -2.171471 -0.653034 0.518252
C 0.306504 -0.449711 0.803750
C -1.066842 -0.511657 1.479245
C 0.466635 -0.702183 -0.582092
C 1.459546 -0.155571 1.568641
C 2.883096 -0.366683 -0.404313
C 1.738883 -0.661462 -1.184828
C 2.745703 -0.111083 0.982681
C -3.125416 0.241313 0.542368
C -5.244192 1.259692 -0.267897
C -4.401686 -0.883285 -1.263273
C 5.313789 -0.052430 -0.333952
H -1.083343 -1.395464 2.152477
H -1.179355 0.384601 2.140011
H -0.425128 -0.930423 -1.173775
H 1.360524 0.046396 2.643647
H 1.869949 -0.854570 -2.254376
H 3.614340 0.122790 1.606081
H -3.133258 1.113240 1.231196
H -6.254940 0.846015 -0.076682
H -5.276555 1.806597 -1.232910
H -5.013448 1.986473 0.530002
H -3.598228 -1.617261 -1.094318
H -4.329785 -0.500479 -2.301607
H -5.386724 -1.374767 -1.139556
H 6.137950 -0.096285 -1.061565
H 5.481455 -0.803196 0.463671
H 5.269217 0.958987 0.116728


