%chk=000073507.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000073507

0 1
 O    4.094700       1.399500     -0.8960000    
 O    6.867700      -1.722700       1.064000    
 N    4.429000     -0.2840000      0.6205000    
 C    5.529900     -0.3492000     -0.3612000    
 C   -1.270800      3.9000001E-02 -5.3800002E-02
 C  -0.1193000      0.7728000      0.6369000    
 C   -2.625600      0.4966000      0.4915000    
 C    1.259300      0.3738000      0.1051000    
 C   -3.777100     -0.2596000     -0.1734000    
 C    2.406200       1.122700      0.7748000    
 C    5.429100      0.9656000      -1.126600    
 C   -5.132600      0.2210000      0.3474000    
 C    3.696000      0.6892000      0.1825000    
 C   -6.285700     -0.5125000     -0.3420000    
 C    6.859300     -0.4865000      0.3735000    
 C    5.290800      -1.558500      -1.270400    
 C   -7.641000     -6.0000001E-03  0.1565000    
 C   -8.830300     -0.6914000     -0.5198000    
 C   -10.17950     -0.2099000     -9.4999997E-03
 H   -1.227800      0.2226000      -1.134100    
 H   -1.156700      -1.041300      9.6000001E-02
 H  -0.2516000       1.854300      0.5075000    
 H  -0.1583000      0.5757000       1.715300    
 H   -2.660200      0.3356000       1.575800    
 H   -2.744000       1.573500      0.3204000    
 H    1.291400      0.5513000     -0.9777000    
 H    1.399300     -0.7065000      0.2407000    
 H   -3.730000     -0.1157000      -1.259800    
 H   -3.670100      -1.334600      1.5400000E-02
 H    2.294000       2.204800      0.6458000    
 H    2.423300      0.9190000       1.851100    
 H    5.601100      0.8517000      -2.201500    
 H    6.107600       1.737200     -0.7458000    
 H   -5.189100      6.0500000E-02   1.430900    
 H   -5.229600       1.299800      0.1745000    
 H   -6.219200     -0.3670000      -1.426900    
 H   -6.204000      -1.589800     -0.1539000    
 H    6.994200      0.3168000       1.106100    
 H    7.701100     -0.4703000     -0.3270000    
 H    5.205600      -2.489200     -0.6987000    
 H    4.355900      -1.450000      -1.833100    
 H    6.104000      -1.674100      -1.995200    
 H   -7.707200     -0.1606000       1.240700    
 H   -7.709400       1.075700     -1.3400000E-02
 H   -8.779400     -0.5218000      -1.601900    
 H   -8.760800      -1.774700     -0.3647000    
 H    7.723500      -1.790400       1.520800    
 H   -10.30070      0.8643000     -0.1813000    
 H   -10.28110     -0.3999000       1.063600    
 H   -10.99050     -0.7319000     -0.5269000    


%chk=000073507-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000073507

0 1
O 4.031389 0.970350 -1.164811
O 7.299290 -0.602783 1.615253
N 4.708035 -0.380219 0.604744
C 5.852765 -0.443631 -0.389969
C -1.322309 0.096950 -0.230233
C -0.095250 0.575453 0.577990
C -2.665404 0.389853 0.476310
C 1.248687 0.237810 -0.103846
C -3.898774 -0.063570 -0.336811
C 2.460276 0.748689 0.723165
C 5.396189 0.486196 -1.564344
C -5.237933 0.197392 0.389270
C 3.782948 0.395815 0.109433
C -6.475075 -0.236431 -0.429117
C 7.095451 0.112529 0.359271
C 6.070001 -1.903677 -0.832029
C -7.812215 0.006510 0.306826
C -9.050794 -0.418037 -0.515137
C -10.381279 -0.178306 0.231056
H -1.317480 0.583305 -1.227866
H -1.237276 -0.994233 -0.415384
H -0.164680 1.672588 0.733064
H -0.120356 0.115123 1.587784
H -2.674262 -0.113538 1.465765
H -2.742578 1.478320 0.681172
H 1.284166 0.684968 -1.115396
H 1.332705 -0.859445 -0.233975
H -3.904582 0.458785 -1.316376
H -3.810695 -1.146911 -0.563218
H 2.391776 1.849973 0.817497
H 2.439189 0.319202 1.739488
H 5.288304 -0.048598 -2.521904
H 6.034680 1.377896 -1.694298
H -5.236431 -0.337939 1.361897
H -5.319545 1.278113 0.630447
H -6.484549 0.309400 -1.395901
H -6.387495 -1.313983 -0.682218
H 6.951286 1.200958 0.539835
H 8.016795 -0.036760 -0.231245
H 6.392299 -2.513181 0.028675
H 5.137714 -2.332545 -1.240015
H 6.854525 -1.960889 -1.609909
H -7.806778 -0.545867 1.269940
H -7.898349 1.082451 0.567238
H -9.058279 0.137546 -1.475226
H -8.961588 -1.491898 -0.778714
H 6.397265 -0.674130 2.032748
H -10.509388 0.892574 0.478440
H -10.410635 -0.746354 1.180141
H -11.250358 -0.490923 -0.376809


