%chk=000083590.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000083590

0 1
 O   0.3987000       1.571500     -0.5187000    
 N   -1.894600      0.1381000     -0.1295000    
 N    1.731300     -0.2433000      3.4100000E-02
 C  -0.6693000     -0.5790000     -0.4636000    
 C   0.5185000      0.3586000     -0.3236000    
 C   -1.841400      0.6354000       1.246300    
 C   -3.062700     -0.7247000     -0.3127000    
 C    2.964400      0.5215000      0.2070000    
 C    1.855000      -1.678100      0.2607000    
 H  -0.6888000     -0.9162000      -1.506600    
 H  -0.5808000      -1.455500      0.1840000    
 H   -1.680100     -0.1729000       1.969600    
 H   -2.787500       1.126700       1.504000    
 H   -1.071100       1.395600       1.403700    
 H   -3.039100      -1.600900      0.3455000    
 H   -3.123600      -1.073700      -1.349600    
 H   -3.986300     -0.1694000     -0.1149000    
 H    3.700800      0.1744000     -0.5235000    
 H    3.340400      0.3601000       1.221400    
 H    2.787500       1.589200      5.5700000E-02
 H    1.435600      -1.914800       1.242800    
 H    2.907600      -1.976800      0.2381000    
 H    1.326900      -2.237300     -0.5162000    


%chk=000083590-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000083590

0 1
O 0.530701 1.573124 0.275916
N -1.904450 0.119773 -0.059833
N 1.844284 -0.340576 0.141032
C -0.633941 -0.605089 0.063617
C 0.608072 0.311494 0.164671
C -2.273873 0.892528 1.145373
C -2.993292 -0.771237 -0.506310
C 3.076227 0.467048 0.174641
C 2.023895 -1.786970 -0.056923
H -0.521540 -1.244991 -0.833283
H -0.626113 -1.301515 0.949851
H -2.446982 0.241029 2.041701
H -3.203904 1.453231 0.944454
H -1.473831 1.613991 1.367390
H -3.239235 -1.584019 0.226513
H -2.726126 -1.245774 -1.468395
H -3.908822 -0.174230 -0.664781
H 3.658257 0.334664 -0.758349
H 3.710953 0.174506 1.032957
H 2.788765 1.524600 0.274558
H 2.908182 -2.125023 0.513495
H 2.188294 -2.042360 -1.124332
H 1.155877 -2.355702 0.310037


