%chk=000159022.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000159022

2 1
 O   -2.656300       2.289900      0.9367000    
 O   -2.417900       1.736100      -1.250700    
 N   -3.140300     -0.9351000      1.7800000E-02
 N    4.303800     -5.2600000E-02 -2.8999999E-02
 C   -2.084600      2.7500000E-02  0.4461000    
 C  -0.7118000     -0.4834000     -8.1000002E-03
 C   0.4793000      0.3481000      0.4865000    
 C    1.837100     -0.2175000      4.9199998E-02
 C    3.062000      0.5941000      0.4541000    
 C   -2.827700      -2.342400      0.5375000    
 C   -4.507800     -0.5110000      0.5639000    
 C   -3.227200     -0.9930000      -1.510800    
 C   -2.398200       1.415100     -6.9600001E-02
 C    4.260900     -0.2529000      -1.551400    
 C    5.533400      0.8060000      0.3025000    
 C    4.495400      -1.428900      0.6253000    
 H   -2.102000      5.0400000E-02   1.544300    
 H  -0.6324000     -0.4944000      -1.099500    
 H  -0.5219000      -1.500700      0.3441000    
 H   0.4524000      0.4041000       1.581600    
 H   0.3896000       1.375500      0.1138000    
 H    1.893600      -1.232700      0.4544000    
 H    1.782700     -0.3097000      -1.040200    
 H    3.124100      0.6904000       1.544600    
 H    3.011300       1.601600      2.3600001E-02
 H   -2.546600      -2.274100       1.592500    
 H   -3.731400      -2.952000      0.4344000    
 H   -2.040200      -2.797100     -6.9100000E-02
 H   -5.246700      -1.261200      0.2654000    
 H   -4.439700     -0.4579000       1.654500    
 H   -4.783000      0.4596000      0.1428000    
 H   -3.644800     -6.6299997E-02  -1.906400    
 H   -2.263700      -1.241800      -1.954500    
 H   -3.929900      -1.797400      -1.759000    
 H    3.968400      0.6928000      -2.016800    
 H    5.263700     -0.5408000      -1.883500    
 H    3.566000      -1.058100      -1.802100    
 H    5.415700       1.773600     -0.1941000    
 H    5.575300      0.9326000       1.388200    
 H    6.429600      0.2942000     -5.9999999E-02
 H    3.753000      -2.131300      0.2402000    
 H    5.495000      -1.791900      0.3656000    
 H    4.406700      -1.310800       1.709100    
 H   -2.857000       3.188100      0.5973000    


%chk=000159022-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000159022

2 1
O -2.339423 2.218004 0.958281
O -2.290171 1.652585 -1.306274
N -3.311931 -0.964296 0.052075
N 4.432816 0.001646 -0.067436
C -2.050632 -0.103366 0.420962
C -0.718571 -0.670411 -0.131147
C 0.498969 0.121629 0.422701
C 1.841725 -0.431689 -0.132864
C 3.012616 0.414208 0.405699
C -3.286844 -2.266326 0.859466
C -4.581008 -0.189337 0.445063
C -3.378904 -1.295410 -1.445171
C -2.249938 1.335598 -0.099902
C 4.558729 0.108309 -1.588121
C 5.437032 0.966616 0.577481
C 4.768403 -1.423717 0.374739
H -2.041042 -0.075612 1.524073
H -0.720635 -0.604705 -1.234355
H -0.607352 -1.733201 0.152857
H 0.504047 0.076275 1.529565
H 0.405814 1.189579 0.144617
H 1.948378 -1.490159 0.169751
H 1.808233 -0.397864 -1.237749
H 3.043727 0.374918 1.509442
H 2.894859 1.470245 0.103121
H -3.328968 -2.029071 1.933615
H -4.165769 -2.866723 0.579140
H -2.374228 -2.833102 0.629394
H -5.443286 -0.867299 0.358668
H -4.484587 0.166291 1.482094
H -4.715951 0.660144 -0.240216
H -3.265605 -0.368179 -2.025626
H -2.580494 -2.007271 -1.698757
H -4.357678 -1.756330 -1.647646
H 4.285886 1.127127 -1.903280
H 5.601839 -0.098471 -1.872243
H 3.898812 -0.627983 -2.067922
H 5.209066 1.994093 0.255440
H 5.361237 0.889804 1.672749
H 6.453749 0.694907 0.256031
H 4.107605 -2.136968 -0.137844
H 5.813895 -1.640180 0.107460
H 4.642093 -1.503549 1.465344
H -2.448615 3.163940 0.657925


