%chk=000144218.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000144218

0 1
 O    1.544700      0.8514000      8.9999996E-03
 O    2.422400      -1.226100      0.4432000    
 N   -2.328400      0.1639000     -0.9235000    
 N    3.751700      0.5229000     -0.3024000    
 C   -1.672800      -1.074600     -0.4623000    
 C   -2.213200       1.049100      0.2509000    
 C   -2.179300      -1.265300      0.9715000    
 C   -2.538300      0.1453000       1.445400    
 C  -0.1560000     -0.8029000     -0.5048000    
 C  -0.7520000       1.539300      0.2818000    
 C   0.2537000      0.3836000      0.3803000    
 C   -3.712900     -4.9400002E-02  -1.337700    
 C    2.564100     -6.1999999E-02  8.3499998E-02
 C    5.016300     -0.1752000     -0.3348000    
 H   -1.899600      -1.937700      -1.098500    
 H   -2.879400       1.917300      0.1969000    
 H   -3.077600      -1.894000      0.9840000    
 H   -1.438000      -1.738300       1.624000    
 H   -1.988700      0.4242000       2.350200    
 H   -3.607700      0.1889000       1.683200    
 H   0.3394000      -1.727900     -0.1956000    
 H   0.1581000     -0.6222000      -1.542000    
 H  -0.5433000       2.134500     -0.6179000    
 H  -0.5992000       2.222200       1.127000    
 H   0.3006000      6.0899999E-02   1.428800    
 H   -3.746100     -0.7205000      -2.203000    
 H   -4.158200      0.8987000      -1.658900    
 H   -4.350400     -0.4743000     -0.5556000    
 H    3.737000       1.499700     -0.5793000    
 H    4.904500      -1.215900     -2.2000000E-02
 H    5.708200      0.3415000      0.3348000    
 H    5.402600     -0.1337000      -1.356100    


%chk=000144218-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000144218

0 1
O 1.575002 0.732826 -0.289661
O 2.586255 -1.021619 0.937403
N -2.494416 0.200671 -0.934580
N 3.831778 0.508315 -0.345857
C -1.799067 -1.081757 -0.580567
C -2.176423 1.045422 0.263399
C -2.156794 -1.336371 0.931205
C -2.405142 0.101468 1.503839
C -0.279085 -0.857957 -0.789828
C -0.695716 1.490780 0.138461
C 0.226501 0.259337 0.147527
C -3.946326 0.043491 -1.186080
C 2.670995 -0.024894 0.170996
C 5.149352 -0.052540 -0.042559
H -2.148642 -1.894872 -1.240340
H -2.830172 1.934797 0.282495
H -3.065169 -1.958936 1.016207
H -1.344049 -1.866214 1.458646
H -1.720285 0.347053 2.335004
H -3.435847 0.205071 1.886946
H 0.285106 -1.788971 -0.598585
H -0.114826 -0.550920 -1.838587
H -0.572561 2.031988 -0.816456
H -0.420884 2.174478 0.963439
H 0.343679 -0.142121 1.171422
H -4.090769 -0.600833 -2.071635
H -4.381818 1.032677 -1.414713
H -4.526160 -0.399866 -0.340595
H 3.739798 1.322872 -0.952871
H 5.000896 -0.919818 0.620329
H 5.792819 0.682650 0.476228
H 5.664170 -0.392807 -0.960532


