%chk=000039560.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000039560

0 1
 O    1.524000       1.357100     -3.7700001E-02
 O    2.155100      -2.593500       1.269100    
 N    2.233100      -1.766500      -1.216000    
 N    1.498300      -1.382400       1.032800    
 C   0.9004000      0.2409000     -0.6701000    
 C  -0.5627000      0.2104000     -0.3825000    
 C   -1.452400     -0.2764000      -1.340200    
 C   -1.041600      0.6690000      0.8448000    
 C   -3.299400      0.1538000      0.1563000    
 C    1.597400      -1.055900     -0.2232000    
 C   -2.820700     -0.3046000      -1.071000    
 C   -2.410000      0.6406000       1.114200    
 C    2.916900       1.392000     -0.3074000    
 C   -4.762200      0.1227000      0.4445000    
 C    3.523700       2.592800      0.3865000    
 H    1.035800      0.3712000      -1.752400    
 H   -1.092300     -0.6394000      -2.299400    
 H  -0.3682000       1.044700       1.610500    
 H   -3.503400     -0.6885000      -1.824300    
 H   -2.770600      0.9969000       2.075500    
 H    3.428600      0.5034000      7.4500002E-02
 H    3.087100       1.467800      -1.387400    
 H   -5.049100      0.9348000       1.121200    
 H   -5.348400      0.2480000     -0.4723000    
 H   -5.033700     -0.8316000      0.9067000    
 H    4.598700       2.654200      0.1953000    
 H    3.050600       3.517700      4.0399998E-02
 H    3.359800       2.537000       1.467800    
 H    2.254800      -1.447600      -2.178700    
 H    2.705100      -2.640000      -1.008900    
 H    2.004900      -2.714000       2.221800    


%chk=000039560-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000039560

0 1
O 1.550460 1.237569 0.449338
O 2.678744 -3.044055 -0.967798
N 1.693392 -1.595584 0.948432
N 2.165043 -1.704920 -1.407304
C 1.053983 0.282043 -0.551467
C -0.474274 0.235294 -0.446977
C -1.198930 -0.675535 -1.252585
C -1.184540 1.099462 0.419245
C -3.332702 0.138021 -0.324035
C 1.684371 -1.093413 -0.330197
C -2.608538 -0.719938 -1.190802
C -2.594450 1.045781 0.478328
C 2.978897 1.570095 0.271489
C -4.850028 0.091171 -0.254020
C 3.337925 2.606375 1.334833
H 1.348687 0.605299 -1.572943
H -0.656458 -1.354821 -1.921367
H -0.624107 1.808654 1.034288
H -3.153826 -1.431513 -1.822813
H -3.130530 1.722462 1.156195
H 3.593497 0.652244 0.379785
H 3.135207 1.971745 -0.752632
H -5.295456 1.069788 -0.514833
H -5.263226 -0.661772 -0.947189
H -5.198597 -0.162239 0.765060
H 4.401609 2.893045 1.245266
H 2.719578 3.513223 1.219373
H 3.171288 2.199035 2.347285
H 1.331382 -1.032635 1.713883
H 2.070222 -2.527833 1.103369
H 3.010976 -3.422448 -1.818809


