%chk=000080760.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000080760

0 1
 O   -2.644800      -1.593500      2.2000000E-03
 N   -1.598100      0.5184000     -3.9999999E-04
 N   0.3562000       2.581900      7.9999998E-04
 N    3.845500     -0.7861000      3.0000001E-04
 C  -0.2345000      0.2112000     -3.0000001E-04
 C   0.7297000       1.219200       0.000000    
 C   0.1564000      -1.127800     -6.0000003E-04
 C    2.084700      0.8881000      1.9999999E-04
 C    2.475500     -0.4509000     -9.9999997E-05
 C    1.511400      -1.458900     -6.0000003E-04
 C   -2.681800     -0.3672000     -6.9999998E-04
 C   -4.000100      0.3654000     -6.9999998E-04
 H  -0.5232000      -1.967400     -1.2000001E-03
 H    2.837900       1.673300      6.9999998E-04
 H    1.804700      -2.505700     -8.9999998E-04
 H   -1.833100       1.506000     -5.0000002E-04
 H    1.076300       3.292800       0.000000    
 H  -0.6113000       2.867500     -1.4000000E-03
 H    4.129100      -1.756800     -6.0000003E-04
 H    4.545300     -5.6100000E-02 -9.9999997E-05
 H   -4.084700      0.9741000      0.9039000    
 H   -4.823600     -0.3536000     -2.3600001E-02
 H   -4.067300       1.008900     -0.8824000    


%chk=000080760-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000080760

0 1
O -2.683193 -1.612518 -0.006180
N -1.638749 0.499011 -0.003172
N 0.373025 2.574224 -0.003007
N 3.915339 -0.769658 0.003065
C -0.244582 0.160457 -0.002440
C 0.730616 1.213268 -0.001898
C 0.204769 -1.183609 -0.001797
C 2.109284 0.882204 0.000121
C 2.549370 -0.465793 0.001138
C 1.573621 -1.501632 -0.000085
C -2.748748 -0.346049 -0.003717
C -4.086769 0.404776 0.002957
H -0.546791 -1.975372 -0.002707
H 2.847966 1.695077 0.000667
H 1.886079 -2.552125 0.000361
H -1.872189 1.491670 -0.000943
H 1.105437 3.277381 -0.002161
H -0.581476 2.913515 -0.008722
H 4.227269 -1.735566 0.003391
H 4.616903 -0.036172 0.003542
H -4.202773 1.017074 0.917089
H -4.898164 -0.336796 -0.025630
H -4.186043 1.069434 -0.875873


