%chk=000091910.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000091910

0 1
 O   -4.201400     -0.4188000       1.143700    
 O   -4.786800      0.7908000     -0.6014000    
 N    3.910300      0.1724000     -0.1571000    
 N   -3.962700      0.1868000      9.3500003E-02
 C    2.513900      0.1501000      3.7300002E-02
 C   0.4478000      -1.087000      0.2324000    
 C  -0.2492000      0.1066000      0.4204000    
 C    1.829200      -1.065200      4.0899999E-02
 C    1.817000       1.343700      0.2253000    
 C   0.4356000       1.321900      0.4170000    
 C  -0.2531000      -2.407400      0.2299000    
 C   -1.692100      0.1174000      0.6236000    
 C    4.718400       1.216500      0.4412000    
 C    4.558300     -0.8565000     -0.9464000    
 C   -2.607500      0.1881000     -0.3603000    
 C   -2.477600      0.2409000      -1.840000    
 H    2.359700      -2.004300     -9.2500001E-02
 H    2.317800       2.307500      0.2159000    
 H  -9.2600003E-02   2.261800      0.5599000    
 H   0.4525000      -3.243700      0.1734000    
 H  -0.8313000      -2.542100       1.150200    
 H  -0.9209000      -2.485400     -0.6342000    
 H   -1.962500      9.8099999E-02   1.677800    
 H    5.773500      0.9239000      0.4850000    
 H    4.657200       2.138900     -0.1458000    
 H    4.406600       1.424500       1.471000    
 H    5.548200     -0.5298000      -1.284000    
 H    4.696400      -1.768900     -0.3568000    
 H    3.982000      -1.094200      -1.847800    
 H   -2.812300       1.205600      -2.236500    
 H   -3.055300     -0.5578000      -2.318400    
 H   -1.436700      0.1107000      -2.154300    


%chk=000091910-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000091910

0 1
O -4.250267 0.829632 1.446994
O -5.069951 0.115509 -0.561150
N 4.013353 0.183693 -0.108858
N -4.082580 0.362886 0.246869
C 2.632921 0.203406 0.082921
C 0.411475 -0.912053 -0.131948
C -0.240012 0.256189 0.398021
C 1.814708 -0.914156 -0.274739
C 1.980712 1.332330 0.680434
C 0.593169 1.331234 0.843654
C -0.334422 -2.203255 -0.436298
C -1.681251 0.432636 0.584069
C 4.835225 1.322552 0.326583
C 4.660849 -0.989824 -0.711741
C -2.715767 0.080467 -0.251413
C -2.655200 -0.423262 -1.667869
H 2.284383 -1.829766 -0.647414
H 2.556852 2.197309 1.018672
H 0.114101 2.204844 1.302327
H 0.277731 -3.074836 -0.144392
H -1.290732 -2.258559 0.108807
H -0.561164 -2.310396 -1.513457
H -1.990439 0.972451 1.491481
H 5.890022 1.128541 0.077735
H 4.533301 2.260448 -0.180600
H 4.767342 1.486425 1.420934
H 5.736054 -0.789904 -0.839002
H 4.554685 -1.894723 -0.078784
H 4.236645 -1.217631 -1.709425
H -3.350043 0.155880 -2.299294
H -2.958549 -1.482549 -1.754460
H -1.630750 -0.310419 -2.055758


