%chk=000165894.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000165894

0 1
 O  -0.4941000      0.2952000       1.510100    
 O   -1.878500      -1.688100      0.5256000    
 O   -1.650300       2.811700      0.6375000    
 O   -2.326800      -3.701100     -0.5089000    
 O   -2.779800       1.559900     -0.9826000    
 N    4.518800     -0.5730000      0.2310000    
 C    1.674300     -0.5649000      0.8101000    
 C    2.304100      -1.501000     -0.2328000    
 C    3.518700     -0.7359000     -0.8518000    
 C   0.2842000     -0.9448000       1.371300    
 C    2.704400     -0.2672000       1.917500    
 C    1.274500      0.7007000      0.1262000    
 C    3.096600      0.5944000      -1.565600    
 C    4.047100      0.2343000       1.360500    
 C    1.932200       1.305200     -0.9299000    
 C  -0.4857000      -1.991400      0.5241000    
 C    1.285500      -1.980100      -1.235500    
 C   7.1500003E-02   1.160400      0.6129000    
 C   6.6999998E-03  -2.183400     -0.8857000    
 C    5.820200     -0.1150000     -0.2445000    
 C    1.392800       2.496700      -1.417700    
 C  -0.4758000       2.338100      0.1535000    
 C   0.2066000       3.018200     -0.8632000    
 C   -2.694000      -2.638600     -2.6600000E-02
 C   -4.127100      -2.167400      5.3599998E-02
 C   -2.793800       2.336000     -3.6800001E-02
 C   -5.092600      -3.166500     -0.5596000    
 C   -4.035000       2.930400      0.5895000    
 C   -5.304600       2.437300     -8.2099997E-02
 H    2.685500      -2.406600      0.2628000    
 H    3.971900      -1.387200      -1.612000    
 H   0.3762000      -1.346600       2.388800    
 H    2.883700      -1.188800       2.487800    
 H    2.319700      0.4718000       2.632100    
 H    2.793400      0.3335000      -2.588600    
 H    3.940300       1.284700      -1.662500    
 H    3.961400       1.291100       1.078900    
 H    4.782000      0.1926000       2.174300    
 H  -0.3552000      -2.960200       1.028400    
 H    1.604000      -2.185800      -2.252800    
 H  -0.6560000      -2.532400      -1.670300    
 H    5.810200      0.9275000     -0.5776000    
 H    6.176500     -0.7401000      -1.070600    
 H    6.565800     -0.2027000      0.5538000    
 H    1.867300       3.016400      -2.245700    
 H  -0.1989000       3.945200      -1.262300    
 H   -4.382800      -2.014100       1.107300    
 H   -4.207800      -1.213100     -0.4776000    
 H   -5.039400      -4.131600     -4.4900000E-02
 H   -6.120100      -2.796700     -0.4884000    
 H   -4.862400      -3.337600      -1.616500    
 H   -3.976200       4.020300      0.5036000    
 H   -4.052900       2.653400       1.648600    
 H   -5.390000       1.347900     -9.1000004E-03
 H   -6.184600       2.882300      0.3922000    
 H   -5.316400       2.703200      -1.144300    


%chk=000165894-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000165894

0 1
O -0.731445 -0.113894 0.811292
O -1.747795 -2.090418 -0.773410
O -1.816363 2.686116 0.179593
O -2.394612 -2.851618 1.329733
O -3.101304 1.089435 -0.966287
N 4.498084 -0.486251 0.495236
C 1.598103 -0.770844 0.451830
C 2.524824 -1.553927 -0.518372
C 3.763361 -0.639879 -0.794402
C 0.169540 -1.339561 0.716168
C 2.365392 -0.547887 1.789339
C 1.252337 0.555374 -0.205637
C 3.385010 0.708791 -1.509969
C 3.708244 0.173866 1.564000
C 2.075281 1.323622 -1.033766
C -0.328709 -2.326529 -0.398966
C 1.765263 -1.981141 -1.754961
C -0.066179 0.908981 0.113390
C 0.449312 -2.302498 -1.695649
C 5.853111 0.074462 0.360145
C 1.561635 2.580375 -1.457373
C -0.564118 2.166085 -0.270799
C 0.274054 3.000874 -1.049955
C -2.702227 -2.380488 0.209608
C -4.091734 -2.052931 -0.300974
C -3.031111 2.036555 -0.163822
C -5.173554 -2.189783 0.784834
C -4.171750 2.694986 0.593681
C -5.551709 2.136299 0.205225
H 2.931398 -2.445393 0.004163
H 4.446789 -1.189848 -1.472360
H 0.058327 -1.818956 1.699757
H 2.555104 -1.536830 2.250332
H 1.742801 0.040780 2.489386
H 3.293233 0.512039 -2.598251
H 4.225969 1.422781 -1.406212
H 3.522886 1.253435 1.340425
H 4.302831 0.139304 2.496670
H -0.281241 -3.340381 0.055160
H 2.304758 -2.041358 -2.709914
H -0.107524 -2.625649 -2.582662
H 5.879285 1.160457 0.092514
H 6.410130 -0.480935 -0.416153
H 6.394262 -0.042284 1.317035
H 2.157491 3.230804 -2.107617
H -0.115610 3.978754 -1.351119
H -4.052379 -1.030341 -0.720141
H -4.302347 -2.723910 -1.157393
H -4.981333 -1.496816 1.622870
H -6.168687 -1.961081 0.363335
H -5.195838 -3.210957 1.202548
H -4.110825 3.785659 0.417719
H -3.974383 2.557654 1.674399
H -5.615890 1.054875 0.416579
H -6.345386 2.649394 0.776067
H -5.749461 2.277134 -0.871368


