%chk=000089125.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000089125

0 1
 O   -2.472600     -0.1993000      0.2043000    
 O   0.2668000     -0.5779000     -0.2566000    
 O    1.941300      -2.005300      0.4233000    
 N    1.417300       2.652000     -0.5252000    
 C   -2.012600      -1.159000     -0.7395000    
 C  -0.6547000      -1.672700     -0.3011000    
 C   -3.735500      0.3339000     -0.1690000    
 C   -4.170300       1.345300      0.8701000    
 C    1.536300     -0.8909000      0.1239000    
 C    2.374500      0.3402000      0.1246000    
 C    3.661200      0.2193000      0.4792000    
 C    1.848100       1.614500     -0.2339000    
 H   -2.723900      -1.989800     -0.8022000    
 H   -1.925900     -0.6789000      -1.721200    
 H  -0.2943000      -2.428100      -1.007900    
 H  -0.7285000      -2.107900      0.7023000    
 H   -3.658000      0.8214000      -1.147300    
 H   -4.474700     -0.4725000     -0.2308000    
 H   -5.141600       1.777100      0.6131000    
 H   -4.241800      0.8773000       1.857500    
 H   -3.435300       2.152800      0.9533000    
 H    4.101200     -0.7323000      0.7597000    
 H    4.323600       1.080300      0.5001000    


%chk=000089125-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000089125

0 1
O -2.371782 -0.420750 0.192853
O 0.390482 -0.862333 -0.814758
O 1.242365 -1.481511 1.279299
N 2.031774 1.845490 -2.142653
C -2.021703 -1.171598 -1.009197
C -0.699984 -1.876865 -0.743141
C -3.543970 0.449375 -0.000886
C -3.796486 1.175815 1.318941
C 1.247945 -0.746423 0.267425
C 2.213520 0.392587 0.049693
C 3.158102 0.648338 1.001464
C 2.108766 1.181726 -1.151166
H -2.799932 -1.934791 -1.241299
H -1.921248 -0.497002 -1.887283
H -0.479730 -2.619717 -1.528864
H -0.689362 -2.351683 0.252869
H -3.339498 1.170740 -0.822888
H -4.424643 -0.165850 -0.293050
H -4.667335 1.850131 1.227600
H -3.995281 0.451352 2.127207
H -2.915149 1.776435 1.601819
H 3.195828 0.021277 1.899002
H 3.877923 1.464756 0.893712


