%chk=000141563.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000141563

0 1
 O   0.2057000       1.189700       1.274300    
 O   -2.441300      -2.080100     -0.6610000    
 O    1.732800      -1.274500      -2.356000    
 N   0.9690000      0.1252000     -0.6503000    
 N  -0.3732000      -1.608800      -1.534900    
 C   -1.428800      4.4199999E-02 -8.3499998E-02
 C  -1.6300000E-02  0.5007000      0.2770000    
 C   -1.999900       1.065900      -1.083400    
 C   -2.309200      2.9500000E-02   1.176200    
 C   -1.477400      -1.320900     -0.7499000    
 C    2.277200      0.7601000     -0.5417000    
 C    3.200000      2.9100001E-02  0.4277000    
 C   0.8395000     -0.9246000      -1.580100    
 C   -1.920600       2.451300     -0.5318000    
 C   -1.785200     -0.9462000       2.176500    
 C    4.564700      0.7079000      0.5654000    
 C    5.440600     -7.4999998E-03   1.582200    
 C   -2.985400       3.240500     -0.3505000    
 C   -2.492200      -1.981300       2.643800    
 H   -3.032800      0.8026000      -1.347800    
 H   -1.436400       1.046500      -2.025600    
 H   -3.350000     -0.2057000      0.9162000    
 H   -2.333700       1.009000       1.669400    
 H    2.741700      0.8024000      -1.533800    
 H    2.138600       1.795600     -0.2079000    
 H    2.723300     -2.9500000E-02   1.414200    
 H    3.340700      -1.006300      9.3199998E-02
 H  -0.4323000      -2.449300      -2.103100    
 H  -0.9425000       2.883400     -0.3388000    
 H  -0.7882000     -0.7983000       2.581600    
 H    5.072000      0.7212000     -0.4062000    
 H    4.431200       1.750200      0.8773000    
 H    5.616400      -1.046600       1.285900    
 H    6.411200      0.4916000       1.663800    
 H    4.973800     -6.3999998E-03   2.572300    
 H   -2.862300       4.253700      1.6300000E-02
 H   -3.991200       2.893700     -0.5598000    
 H   -2.064700      -2.648900       3.384000    
 H   -3.500700      -2.182700       2.300100    


%chk=000141563-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000141563

0 1
O 0.286294 1.609574 0.831769
O -2.688454 -1.730197 -1.032180
O 1.805207 -1.644215 -2.145806
N 1.035556 0.060685 -0.724828
N -0.440179 -1.627475 -1.549372
C -1.441711 0.204544 -0.174910
C 0.009307 0.667713 0.038852
C -2.172788 1.285591 -1.089428
C -2.171915 0.089564 1.204817
C -1.590072 -1.125982 -0.925086
C 2.422385 0.599990 -0.604689
C 3.218356 -0.058240 0.541895
C 0.864062 -1.098311 -1.514843
C -2.333830 2.650036 -0.454826
C -1.494674 -0.871195 2.161323
C 4.644460 0.528332 0.645061
C 5.462139 -0.109527 1.788495
C -3.524228 3.290842 -0.342012
C -2.003702 -2.070628 2.539009
H -3.162942 0.864797 -1.343884
H -1.600035 1.376709 -2.036251
H -3.207817 -0.232929 1.000517
H -2.200187 1.103735 1.642028
H 2.924137 0.422054 -1.570482
H 2.328025 1.684427 -0.428482
H 2.681831 0.100465 1.496973
H 3.279083 -1.149695 0.366596
H -0.543061 -2.491193 -2.092668
H -1.418238 3.135711 -0.092015
H -0.529479 -0.538651 2.573433
H 5.174349 0.377645 -0.317354
H 4.580573 1.624135 0.802826
H 5.561773 -1.201480 1.643335
H 6.479647 0.318492 1.842260
H 4.973086 0.056988 2.766489
H -3.592598 4.294090 0.093154
H -4.462465 2.834845 -0.682997
H -1.473889 -2.722351 3.243233
H -2.963907 -2.432495 2.151347


