%chk=000126386.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000126386

0 1
 O   -1.460900      -2.659200      0.2431000    
 O    6.493500       1.454800     -0.9712000    
 N  -0.7362000       1.409500      1.2500000E-02
 N    4.009000      0.6740000      0.1533000    
 N   -5.446400       2.342000     -0.1380000    
 C   9.5700003E-02 -0.8430000      0.1648000    
 C   0.2949000      0.5456000      8.5299999E-02
 C   -2.295500     -0.4211000      9.1399997E-02
 C   -1.221400      -1.313500      0.1667000    
 C   -2.002800      0.9511000      1.4600000E-02
 C    2.697800      0.1544000      0.1573000    
 C    1.603800       1.020200      8.3099999E-02
 C    1.194200      -1.717100      0.2396000    
 C    2.492900      -1.217100      0.2358000    
 C   -3.629100     -0.8661000      9.1600001E-02
 C   -3.068000       1.844500     -6.0400002E-02
 C   -4.394500       1.405700     -6.0500000E-02
 C   -4.676000      4.7699999E-02  1.5699999E-02
 C    5.172800     -0.1540000      0.2275000    
 C    6.424000      0.7079000      0.2368000    
 C   -1.547900      -3.366200     -0.9890000    
 H    1.776400       2.094200      2.1700000E-02
 H    1.060500      -2.793800      0.3097000    
 H    3.310000      -1.929100      0.2959000    
 H   -3.876500      -1.922600      0.1585000    
 H   -2.859500       2.912200     -0.1205000    
 H    4.101700       1.683600      0.1692000    
 H    5.211200     -0.8199000     -0.6428000    
 H    5.163800     -0.7613000       1.139700    
 H   -5.701500     -0.3112000      1.8500000E-02
 H    7.319200      8.2300000E-02  0.3015000    
 H    6.429800       1.407700       1.079100    
 H  -0.6101000      -3.297000      -1.549000    
 H   -2.371500      -2.987300      -1.602200    
 H   -1.739900      -4.419300     -0.7655000    
 H   -5.241300       3.330800     -0.1928000    
 H   -6.406900       2.025400     -0.1375000    
 H    5.718300       2.039600      -1.006300    


%chk=000126386-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000126386

0 1
O -1.478905 -2.763674 0.059850
O 6.367845 0.732437 -1.451502
N -0.749696 1.464969 0.118902
N 4.035350 0.770066 0.314330
N -5.519547 2.348825 -0.046873
C 0.094895 -0.883314 0.157860
C 0.289349 0.566695 0.169268
C -2.329089 -0.466043 0.053687
C -1.236694 -1.367681 0.078486
C -2.030098 0.968489 0.072748
C 2.739045 0.219845 0.292791
C 1.624041 1.073928 0.234581
C 1.244593 -1.736172 0.240434
C 2.529824 -1.212080 0.306408
C -3.700923 -0.891533 0.018595
C -3.118084 1.896217 0.035348
C -4.450584 1.455238 -0.010054
C -4.733143 0.033493 -0.013181
C 5.269221 0.045778 0.662661
C 6.469352 0.754201 0.007987
C -1.479045 -3.359388 -1.292772
H 1.740527 2.163742 0.236333
H 1.088502 -2.819436 0.280105
H 3.381808 -1.893407 0.384207
H -3.913504 -1.965410 0.043055
H -2.867694 2.962195 0.047758
H 4.068654 1.779689 0.484687
H 5.214178 -0.978575 0.258252
H 5.422031 -0.029463 1.762687
H -5.777568 -0.302223 -0.030152
H 7.405987 0.228629 0.257140
H 6.546559 1.799969 0.384444
H -0.501301 -3.211446 -1.790383
H -2.278422 -2.916050 -1.917393
H -1.668101 -4.433586 -1.144574
H -5.357979 3.351796 -0.037383
H -6.478452 2.015174 -0.071601
H 5.420672 0.932506 -1.679536


