%chk=000059815.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000059815

0 1
 O    2.381400       1.629900      1.1000000E-03
 N  -4.9000001E-03  0.4670000     -3.9999999E-04
 N    3.609300     -0.3377000     -9.9999997E-05
 C   -1.319200      2.6900001E-02 -1.9999999E-04
 C    1.136200     -0.4163000       0.000000    
 C   -2.401600      0.9281000     -1.9999999E-04
 C    2.417700      0.3963000      7.9999998E-04
 C   -1.602800      -1.352100      1.9999999E-04
 C   -3.718000      0.4668000       0.000000    
 C   -2.153800       2.401500     -6.0000003E-04
 C   -2.919300      -1.813300      3.0000001E-04
 C   -3.976700     -0.9039000      1.9999999E-04
 C    4.922800      0.3019000     -6.0000003E-04
 C    3.628900      -1.795200     -5.0000002E-04
 H    1.125800      -1.042300     -0.8985000    
 H    1.124500      -1.041500      0.8989000    
 H   0.1668000       1.465500     -2.3000001E-03
 H  -0.8125000      -2.098100      1.9999999E-04
 H   -4.554100       1.161100     -9.9999997E-05
 H   -1.595300       2.698300      0.8934000    
 H   -1.596600       2.698000     -0.8955000    
 H   -3.089900       2.970900      9.9999997E-05
 H   -3.121500      -2.880400      5.0000002E-04
 H   -5.001600      -1.263200      3.0000001E-04
 H    5.467700     -1.1300000E-02 -0.8957000    
 H    5.467300     -8.9999996E-03  0.8957000    
 H    4.828300       1.390700     -1.9000000E-03
 H    3.105000      -2.165700      0.8848000    
 H    4.656800      -2.169500      1.2400000E-02
 H    3.127300      -2.162800     -0.8999000    


%chk=000059815-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000059815

0 1
O 2.338947 1.623328 0.005579
N -0.010764 0.390628 0.003029
N 3.608862 -0.336731 0.002271
C -1.337510 -0.035982 0.001578
C 1.125063 -0.503109 0.006919
C -2.391283 0.942397 -0.001389
C 2.408605 0.350709 0.006788
C -1.673310 -1.421962 0.002950
C -3.729262 0.496871 -0.002933
C -2.052010 2.421557 -0.002824
C -3.023244 -1.834163 0.001358
C -4.063350 -0.880181 -0.001612
C 4.874554 0.421025 -0.002247
C 3.679742 -1.809679 -0.005724
H 1.129425 -1.176886 -0.881244
H 1.126799 -1.172058 0.898826
H 0.236318 1.384627 0.002883
H -0.881465 -2.178782 0.005245
H -4.529664 1.247703 -0.005211
H -1.459463 2.710673 0.888882
H -1.456893 2.708343 -0.893575
H -2.967392 3.036574 -0.004948
H -3.258124 -2.905194 0.002453
H -5.111811 -1.195902 -0.002861
H 5.467901 0.186150 -0.905666
H 5.476302 0.182164 0.894510
H 4.630403 1.494020 0.001148
H 3.184353 -2.250575 0.879863
H 4.737740 -2.114449 0.013113
H 3.218530 -2.240517 -0.914760