%chk=000162605.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000162605

0 1
 N   -2.326500     -0.7375000     -0.7393000    
 N   -1.913300      -2.862600     -0.2442000    
 N   -5.132500       2.103800     -0.3823000    
 N   -4.887400      0.1659000       1.011300    
 N   -7.068400      0.8523000      0.2837000    
 N   -7.276800       2.751300      -1.076400    
 N   -6.797600      -1.036200       1.647500    
 C    4.707300     -0.2925000      0.5791000    
 C    3.471000     -0.7031000     -0.2226000    
 C    5.952400     -0.2338000     -0.3086000    
 C    2.220200     -0.7295000      0.6588000    
 C    7.179600      0.2130000      0.4882000    
 C   0.9777000      -1.108800     -0.1528000    
 C    8.453300      0.3113000     -0.3567000    
 C  -0.2999000      -1.172700      0.6918000    
 C    9.696800      0.8359000      0.3674000    
 C   -1.509000      -1.621100     -9.1300003E-02
 C    10.94850      0.8585000     -0.5102000    
 C   -2.186100      0.6987000     -0.7873000    
 C   -3.315000      -1.461600      -1.344000    
 C   -2.918200       1.423200      0.3473000    
 C    12.15070       1.393800      0.2529000    
 C   -3.038500      -2.770100      -1.024500    
 C   -4.412600       1.216800      0.3234000    
 C   -6.452500       1.858800     -0.3572000    
 C   -6.223200      4.6200000E-02  0.9462000    
 H    4.870300      -1.005700       1.396100    
 H    4.536900      0.6899000       1.036400    
 H    3.631300      -1.693600     -0.6654000    
 H    3.320600      8.9999998E-04  -1.050300    
 H    6.139700      -1.220300     -0.7493000    
 H    5.781700      0.4641000      -1.137300    
 H    2.359700      -1.448800       1.474700    
 H    2.068300      0.2554000       1.116600    
 H    7.353500     -0.4862000       1.315400    
 H    6.979000       1.192700      0.9394000    
 H    1.142900      -2.084900     -0.6275000    
 H   0.8442000     -0.3895000     -0.9701000    
 H    8.254600      0.9615000      -1.218400    
 H    8.676100     -0.6824000     -0.7659000    
 H  -0.4821000     -0.2068000       1.175100    
 H  -0.1494000      -1.891400       1.507800    
 H    9.884600      0.2097000       1.248400    
 H    9.491800       1.848100      0.7374000    
 H    11.16890     -0.1535000     -0.8688000    
 H    10.77190       1.484900      -1.392200    
 H   -1.121400      0.9499000     -0.7742000    
 H   -2.572500       1.028500      -1.760100    
 H   -4.099900      -1.005600      -1.931400    
 H   -2.709600       2.497700      0.2780000    
 H   -2.534100       1.093000       1.320000    
 H    11.97240       2.417200      0.5981000    
 H    13.03520       1.401900     -0.3915000    
 H    12.37130      0.7699000       1.125000    
 H   -3.592200      -3.650200      -1.317200    
 H   -6.856800       3.524000      -1.574300    
 H   -8.276900       2.606200      -1.086000    
 H   -6.199500      -1.669600       2.159900    
 H   -7.799600      -1.166100       1.627200    


%chk=000162605-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000162605

0 1
N -2.348477 -0.798630 -0.736044
N -1.875180 -3.014278 -0.649696
N -5.092957 1.376877 -0.625016
N -5.334907 0.729565 1.699849
N -7.328251 1.077641 0.320591
N -7.023854 1.707889 -1.914139
N -7.490897 0.440218 2.569410
C 4.801009 -0.353087 0.473460
C 3.507495 -0.535502 -0.352193
C 6.026164 0.028935 -0.387351
C 2.279884 -0.914641 0.506388
C 7.325374 0.194431 0.432817
C 0.998004 -1.123079 -0.329309
C 8.549216 0.576781 -0.429967
C -0.231622 -1.500403 0.544702
C 9.852311 0.731133 0.386317
C -1.474652 -1.783267 -0.252577
C 11.075089 1.112922 -0.479045
C -2.285852 0.649897 -0.472102
C -3.353178 -1.453953 -1.466714
C -3.084353 1.077775 0.781151
C 12.374277 1.260257 0.342278
C -3.042647 -2.812233 -1.404463
C -4.589850 1.047137 0.602977
C -6.471311 1.378577 -0.704548
C -6.702716 0.759019 1.497437
H 5.018700 -1.292457 1.023703
H 4.637685 0.427794 1.245836
H 3.671217 -1.319787 -1.120387
H 3.292014 0.401584 -0.907585
H 6.181634 -0.747025 -1.166097
H 5.812593 0.973773 -0.930166
H 2.500347 -1.844144 1.071622
H 2.104535 -0.123474 1.266120
H 7.539703 -0.751496 0.973241
H 7.170939 0.968864 1.213412
H 1.159299 -1.929004 -1.071321
H 0.781963 -0.202558 -0.911037
H 8.337794 1.526369 -0.965349
H 8.698436 -0.194413 -1.214778
H -0.411991 -0.701992 1.292628
H 0.000941 -2.421363 1.108623
H 10.065526 -0.218535 0.920731
H 9.705644 1.502194 1.171781
H 11.218151 0.343459 -1.265254
H 10.862031 2.063089 -1.010506
H -1.227210 0.932378 -0.343406
H -2.682237 1.186021 -1.350169
H -4.164204 -0.901658 -1.932892
H -2.797812 2.119708 1.032486
H -2.826570 0.454364 1.654000
H 12.267545 2.044851 1.115257
H 13.232333 1.532950 -0.299592
H 12.625563 0.314469 0.858824
H -3.577975 -3.649355 -1.846738
H -6.410918 1.946064 -2.689478
H -8.035902 1.718238 -2.012139
H -7.044873 0.185573 3.447157
H -8.502121 0.436439 2.463060


