%chk=000161899.chk
%nprocshared=12
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161899

0 1
 O  -4.7899999E-02   3.073500     -4.9899999E-02
 O   -2.436000       3.211600      1.7400000E-02
 N  -0.9991000      -3.006100      3.8300000E-02
 C  -0.7503000     -0.5691000      3.0400001E-02
 C   -2.170300     -0.4309000      7.1000002E-02
 C  -0.1798000      -1.867400      3.7999999E-02
 C   -3.035700      -1.661500      0.1792000    
 C   8.2199998E-02  0.5958000     -1.3000000E-03
 C   -2.351200      -2.843300     -0.4860000    
 C    1.521700      0.4432000     -9.3999999E-03
 C  -0.6100000       1.827000     -1.2100000E-02
 C   -2.790900      0.8208000      7.7799998E-02
 C    1.219300      -1.974700      5.4400001E-02
 C    2.065100     -0.8614000      2.6300000E-02
 C   -1.985600       1.927200      2.5900001E-02
 C  -0.4474000      -4.351600      9.5600002E-02
 C    2.465000       1.506300     -4.3900002E-02
 C    3.457200      -1.067000      2.9700000E-02
 C   -1.198000       3.934100     -3.5999998E-02
 C    3.847000       1.291700     -4.1600000E-02
 C    4.344600      1.8000000E-03 -3.8000001E-03
 H   -3.211700      -1.869600       1.241800    
 H   -4.007900      -1.495000     -0.2991000    
 H   -2.951300      -3.743300     -0.3076000    
 H   -2.303700      -2.701700      -1.573900    
 H   -3.870300      0.9169000      0.1239000    
 H    1.681800      -2.961100      6.9200002E-02
 H   0.2166000      -4.471100      0.9585000    
 H   0.1001000      -4.588700     -0.8229000    
 H   -1.241200      -5.098000      0.2104000    
 H    2.151900       2.544000     -7.4199997E-02
 H    3.867300      -2.075300      5.7399999E-02
 H   -1.187000       4.551600     -0.9415000    
 H   -1.134500       4.592400      0.8379000    
 H    4.526800       2.138400     -6.8899997E-02
 H    5.415500     -0.1748000     -1.4000000E-03


%chk=000161899-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161899

0 1
O -0.002966 3.128320 -0.075517
O -2.393045 3.296361 -0.023117
N -1.020644 -3.049706 0.055280
C -0.785564 -0.584766 0.038748
C -2.211629 -0.446374 0.097572
C -0.178400 -1.923777 0.049053
C -3.068752 -1.693393 0.236861
C 0.085923 0.580131 -0.003866
C -2.399657 -2.892723 -0.449575
C 1.539637 0.432925 0.001955
C -0.587558 1.826244 -0.025617
C -2.824726 0.823729 0.075364
C 1.212710 -2.046100 0.061392
C 2.082501 -0.901984 0.051839
C -1.981737 1.939102 0.008493
C -0.430390 -4.390182 0.008566
C 2.442623 1.540414 -0.034696
C 3.503000 -1.075763 0.067828
C -1.138722 4.086336 -0.083646
C 3.832106 1.343106 -0.017907
C 4.367180 0.024882 0.034300
H -3.207547 -1.931916 1.310695
H -4.071888 -1.524369 -0.195521
H -2.957981 -3.819912 -0.229316
H -2.407461 -2.746310 -1.554124
H -3.911327 0.936856 0.113885
H 1.684116 -3.032677 0.053420
H 0.276035 -4.531515 0.847111
H 0.118061 -4.591436 -0.939016
H -1.231330 -5.141183 0.111038
H 2.042313 2.554914 -0.075113
H 3.907543 -2.094436 0.105834
H -1.116750 4.660379 -1.026615
H -1.071924 4.729052 0.811422
H 4.505950 2.206440 -0.045063
H 5.452596 -0.125968 0.047654


