%chk=000122205.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000122205

0 1
 O   -1.738300      -1.039600      0.9411000    
 O   -3.720500      -1.204500     -0.2251000    
 N    1.524000       1.447100       1.432800    
 N   -3.579800       1.343100      -1.037500    
 C   8.7800004E-02  0.9781000     -0.1933000    
 C   -1.128900      0.9723000      -1.030700    
 C    1.276200      0.2288000     -0.4196000    
 C   -2.450800      0.8765000     -0.2306000    
 C    2.160900      0.5413000      0.6148000    
 C   0.2707000       1.717200      0.9527000    
 C    1.685400     -0.6881000      -1.408200    
 C    3.439600     -1.9400001E-02  0.7104000    
 C   -2.745200     -0.5651000      0.1482000    
 C    2.961500      -1.257000      -1.325400    
 C    3.823500     -0.9263000     -0.2816000    
 C   -1.866200      -2.404300       1.351900    
 H   -1.122400       1.907400      -1.608200    
 H   -1.089700      0.1596000      -1.767200    
 H   -2.432400       1.474600      0.6865000    
 H  -0.3700000       2.416500       1.471500    
 H    1.924900       1.854300       2.266400    
 H    1.028200     -0.9583000      -2.229600    
 H    4.111300      0.2373000       1.522600    
 H   -3.427700       2.314300      -1.307200    
 H   -4.429400       1.336300     -0.4738000    
 H    3.282500      -1.964900      -2.085000    
 H    4.810200      -1.380200     -0.2368000    
 H   -1.002200      -2.654000       1.973600    
 H   -1.872100      -3.063300      0.4785000    
 H   -2.776200      -2.538000       1.944400    


%chk=000122205-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000122205

0 1
O -1.902278 -1.062916 1.122000
O -2.253342 -1.365049 -1.162944
N 1.879625 1.845129 1.252095
N -3.646188 1.271929 -0.924517
C 0.121354 1.445523 -0.160600
C -1.193149 1.603549 -0.884123
C 1.078544 0.354522 -0.282657
C -2.415144 0.911493 -0.195571
C 2.170746 0.633231 0.615458
C 0.650043 2.329544 0.780675
C 1.125727 -0.827369 -1.071830
C 3.285687 -0.224789 0.744960
C -2.187533 -0.609636 -0.161098
C 2.236356 -1.685025 -0.949071
C 3.304101 -1.389080 -0.049456
C -1.552800 -2.502506 1.241975
H -1.470760 2.669618 -0.966875
H -1.116772 1.206218 -1.915947
H -2.490620 1.276092 0.842106
H 0.241560 3.271369 1.143959
H 2.472506 2.309867 1.935657
H 0.311378 -1.070764 -1.762860
H 4.109388 0.000966 1.431822
H -4.506808 1.031818 -0.419558
H -3.657981 0.887468 -1.877792
H 2.287128 -2.595553 -1.556673
H 4.154344 -2.076771 0.022159
H -1.483652 -2.686042 2.323191
H -0.584327 -2.683705 0.746229
H -2.332230 -3.127429 0.774884


