%chk=000016661.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000016661

0 1
 O   0.2971000     -0.3672000       1.012400    
 O   -3.027000      -2.189300     -0.4940000    
 O   -1.036900      -2.358200      0.4170000    
 N   -1.987800      -1.669700     -2.2800000E-02
 C  -0.7453000      0.3671000      0.5292000    
 C   -1.884200     -0.2518000      1.3600000E-02
 C    1.530900     -0.2043000      0.4077000    
 C  -0.6601000       1.759200      0.5568000    
 C   -2.937700      0.5215000     -0.4742000    
 C   -1.713600       2.532400      6.9100000E-02
 C   -2.852300       1.913500     -0.4464000    
 C    1.607500     -0.1798000     -0.9736000    
 C    2.657700     -7.0500001E-02   1.199500    
 C    2.851500     -1.6300000E-02  -1.583100    
 C    3.901700      9.3099996E-02  0.5900000    
 C    3.998500      0.1202000     -0.8013000    
 H   0.2144000       2.258800      0.9652000    
 H   -3.841200      7.6899998E-02 -0.8836000    
 H   -1.648400       3.616200      9.3000002E-02
 H   -3.672600       2.516000     -0.8255000    
 H   0.7331000     -0.3028000      -1.605400    
 H    2.583900     -9.1200002E-02   2.282600    
 H    2.927700      3.9999999E-04  -2.666300    
 H    4.794900      0.1992000       1.198700    
 H    4.967200      0.2463000      -1.275800    


%chk=000016661-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000016661

0 1
O 0.305295 -0.407679 0.646253
O -3.322586 -2.149848 0.807183
O -1.286460 -2.510060 -0.158206
N -2.215560 -1.734184 0.279870
C -0.778478 0.355207 0.206535
C -2.053031 -0.269462 0.126113
C 1.631431 -0.139925 0.203629
C -0.690755 1.752501 -0.010808
C -3.218831 0.487392 -0.129026
C -1.850016 2.499642 -0.299375
C -3.119281 1.872732 -0.354473
C 1.923502 0.235045 -1.126702
C 2.652600 -0.373398 1.147477
C 3.275212 0.397121 -1.504351
C 3.998609 -0.212069 0.751957
C 4.315132 0.178619 -0.570575
H 0.281789 2.246336 0.072813
H -4.181320 -0.031151 -0.152467
H -1.764000 3.579135 -0.462139
H -4.018326 2.458407 -0.567264
H 1.119121 0.376416 -1.855401
H 2.383150 -0.682051 2.161657
H 3.513189 0.681613 -2.535078
H 4.798414 -0.392784 1.478035
H 5.360201 0.302144 -0.872854


