%chk=000002113.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000002113

0 1
 O   -1.457600      -1.297200      -1.283400    
 O   -1.700300      -1.550600      0.9573000    
 N   -1.073700       1.039000       1.462600    
 N    3.892300     -0.5431000      0.2520000    
 C   -1.012000      0.6251000      5.5700000E-02
 C   0.4164000      0.8342000     -0.4961000    
 C    1.506700      2.4499999E-02  0.2237000    
 C   -2.019700       1.465400     -0.7414000    
 C    2.872300      0.2466000     -0.4278000    
 C   -1.424500     -0.8438000     -2.7000001E-03
 H   0.6754000       1.900500     -0.4426000    
 H   0.4347000      0.5689000      -1.561700    
 H    1.560700      0.3185000       1.278400    
 H    1.261600      -1.043800      0.1947000    
 H   -1.983100       1.227000      -1.810600    
 H   -3.047800       1.283300     -0.4056000    
 H   -1.815500       2.537400     -0.6371000    
 H    3.144800       1.306800     -0.3848000    
 H    2.839300     -4.7600001E-02  -1.482300    
 H  -0.4996000      0.4264000       2.039700    
 H   -2.027500      0.9504000       1.811700    
 H    3.952700     -0.2585000       1.228800    
 H    4.803200     -0.3451000     -0.1601000    
 H   -1.722900      -2.240400      -1.330200    


%chk=000002113-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000002113

0 1
O -1.388637 -1.309292 -1.397050
O -1.740166 -1.651941 0.867260
N -1.080827 1.051766 1.491993
N 3.932766 -0.491341 0.302585
C -1.038890 0.623803 0.083613
C 0.396099 0.832498 -0.492088
C 1.507658 0.042713 0.232674
C -2.054945 1.473875 -0.722769
C 2.886822 0.252628 -0.427083
C -1.425559 -0.875832 -0.061473
H 0.604621 1.917298 -0.422869
H 0.385157 0.553886 -1.562803
H 1.570922 0.366863 1.292423
H 1.292151 -1.043266 0.235502
H -2.045260 1.193163 -1.788176
H -3.083796 1.339974 -0.338151
H -1.783734 2.538486 -0.619653
H 3.079520 1.352255 -0.504393
H 2.849800 -0.136820 -1.463009
H -0.489718 0.478737 2.105234
H -2.036767 1.094556 1.864591
H 4.042013 -0.199919 1.279483
H 4.833698 -0.547141 -0.181648
H -1.637027 -2.273049 -1.435994


