%chk=000115147.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000115147

1 1
 O    3.329300      -1.648000     -0.7267000    
 O    3.782200     -0.7044000       1.284700    
 N   -3.400800     -0.1235000      0.1254000    
 N    3.043400       1.781200      0.4475000    
 C   -2.041100     -4.3200001E-02  0.7110000    
 C   -1.038800      0.2522000     -0.3950000    
 C   0.3890000      0.2990000      0.1555000    
 C   -3.769900       1.188400     -0.5817000    
 C   -3.485800      -1.259400     -0.9042000    
 C   -4.450300     -0.3888000       1.214400    
 C    1.404800      0.5617000     -0.9646000    
 C    2.864400      0.6830000     -0.5019000    
 C    3.373400     -0.5981000      0.1356000    
 H   -1.821800     -0.9977000       1.204300    
 H   -2.037800      0.7494000       1.468900    
 H   -1.230400       1.220100     -0.8682000    
 H   -1.053100     -0.5126000      -1.176600    
 H   0.6217000     -0.6505000      0.6517000    
 H   0.4444000       1.086200      0.9154000    
 H   -3.563500       2.018800      9.9699996E-02
 H   -3.207400       1.283600      -1.513500    
 H   -4.837900       1.155300     -0.8205000    
 H   -4.540800      -1.410400      -1.155200    
 H   -2.948200     -0.9837000      -1.814300    
 H   -3.073900      -2.167000     -0.4537000    
 H   -4.201900      -1.336600       1.700700    
 H   -4.409400      0.4351000       1.932800    
 H   -5.438100     -0.4432000      0.7477000    
 H    1.327400     -0.2433000      -1.706600    
 H    1.125900       1.485900      -1.488100    
 H    3.505300      0.8870000      -1.367600    
 H    2.519400       1.600600       1.302200    
 H    2.658000       2.639300      5.4900002E-02
 H    3.657900      -2.474500     -0.3128000    


%chk=000115147-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000115147

1 1
O 3.452839 -1.564850 -0.526700
O 3.724028 -0.511203 1.526377
N -3.538247 -0.138831 0.077405
N 2.798352 1.897878 0.543531
C -2.035168 -0.127010 0.489668
C -1.024554 0.175548 -0.626154
C 0.405704 0.166249 -0.025906
C -3.960606 1.228247 -0.455378
C -3.797371 -1.204282 -0.984515
C -4.366668 -0.464140 1.321009
C 1.485905 0.494234 -1.075449
C 2.871139 0.782774 -0.407277
C 3.390992 -0.459239 0.322755
H -1.840594 -1.123353 0.926471
H -1.953489 0.625069 1.294925
H -1.206882 1.171116 -1.073338
H -1.082413 -0.576756 -1.435517
H 0.611687 -0.825723 0.425552
H 0.491397 0.924160 0.778494
H -3.727629 1.994804 0.299396
H -3.417510 1.444421 -1.385708
H -5.043522 1.214842 -0.653632
H -4.877512 -1.244287 -1.193673
H -3.251954 -0.946668 -1.902698
H -3.453043 -2.179051 -0.606589
H -4.066928 -1.451092 1.704851
H -4.182637 0.304185 2.087200
H -5.434368 -0.476228 1.053125
H 1.599385 -0.326334 -1.807806
H 1.201413 1.409517 -1.630315
H 3.591662 0.968192 -1.234411
H 3.221119 1.693136 1.455147
H 3.064325 2.807922 0.164063
H 3.846746 -2.341348 -0.043705


