%chk=000056736.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000056736

0 1
 O    3.100200      0.8346000      0.2798000    
 O   -2.788300      -1.802200       1.353500    
 O    1.700600      -2.917200     -0.4152000    
 O    3.391400      -1.573200     -2.3000000E-02
 N   -2.272100      0.3806000     -0.4312000    
 N   -2.633000       1.667300     -0.2948000    
 N   -1.529500       2.370000     -6.2799998E-02
 N    2.167100      -1.774500     -0.1984000    
 C  -0.9245000      0.2141000     -0.2918000    
 C  -0.4681000       1.503600     -5.5799998E-02
 C   -3.268100     -0.6284000     -0.6937000    
 C  -9.0300001E-02 -0.9007000     -0.3476000    
 C    1.275000     -0.6664000     -0.1501000    
 C   0.9028000       1.725000      0.1406000    
 C    1.764300      0.6212000      8.9599997E-02
 C   -3.838100      -1.231500      0.5831000    
 C    3.510600       2.177700      0.5179000    
 H   -4.063300     -0.1743000      -1.295000    
 H   -2.792900      -1.405000      -1.303100    
 H  -0.5021000      -1.885800     -0.5363000    
 H    1.210000       2.746500      0.3208000    
 H   -4.350600     -0.4803000       1.193400    
 H   -4.553200      -2.023100      0.3402000    
 H   -2.311500      -1.075700       1.789000    
 H    4.598200       2.162600      0.6465000    
 H    3.089800       2.572000       1.449300    
 H    3.305300       2.823700     -0.3426000    


%chk=000056736-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000056736

0 1
O 3.146175 0.853990 0.253377
O -2.787924 -2.137318 1.164594
O 1.861326 -2.748492 -0.835193
O 3.093976 -1.803145 0.837089
N -2.350046 0.406722 -0.459523
N -2.696613 1.780742 -0.359163
N -1.574568 2.482221 -0.121674
N 2.138072 -1.778834 -0.022524
C -0.982024 0.251367 -0.278296
C -0.494073 1.580523 -0.069219
C -3.392659 -0.595057 -0.705293
C -0.114421 -0.858707 -0.290461
C 1.245542 -0.594514 -0.064654
C 0.881528 1.836483 0.130510
C 1.769732 0.741688 0.129578
C -3.852790 -1.312199 0.581679
C 3.710164 2.200772 0.415489
H -4.244672 -0.066634 -1.167008
H -3.006323 -1.340123 -1.423329
H -0.451596 -1.885425 -0.450205
H 1.226691 2.863690 0.263805
H -4.245508 -0.573156 1.308020
H -4.658788 -2.018290 0.320147
H -2.200376 -1.580610 1.734244
H 4.794333 2.040471 0.491594
H 3.333646 2.678020 1.339776
H 3.480898 2.836416 -0.461061


