%chk=000161887.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000161887

1 1
 O    1.139800       1.716400     -7.6200001E-02
 O  -0.9607000       2.602800     -3.8400002E-02
 N   -3.159400      5.0000002E-04  -1.060300    
 N   -3.063600     -8.9000002E-02   1.099500    
 N    5.603900     -0.1013000     -0.3182000    
 C   -2.322200      4.9899999E-02 -1.1500000E-02
 C   -4.457500     -0.1728000     -0.6257000    
 C   -4.395500     -0.2304000      0.7687000    
 C  -0.8157000      0.2298000     -7.1699999E-02
 C    1.435400     -0.6889000     -0.2025000    
 C  -8.7000001E-03 -0.8378000     -0.1521000    
 C   -2.752700      0.1119000      -2.450700    
 C   -2.536000     -9.0400003E-02   2.453300    
 C    1.978200      0.5893000     -0.1569000    
 C   -5.653400     -0.2808000      -1.325600    
 C   -5.525100     -0.4004000       1.560300    
 C    4.207300     -0.2939000     -0.2791000    
 C  -0.2481000       1.604700     -5.6000002E-02
 C    3.354400      0.8042000     -0.1937000    
 C    2.296900      -1.785300     -0.2879000    
 C    3.680100      -1.586200     -0.3265000    
 C    6.499400      -1.237500     -0.4074000    
 C    6.161600       1.236200     -0.2837000    
 C   -6.802400     -0.4525000     -0.5403000    
 C   -6.739800     -0.5110000      0.8683000    
 C    6.694200      -1.857800      0.9628000    
 C    6.389500       1.670200       1.151600    
 H  -0.4205000      -1.842100     -0.1716000    
 H   -1.769700     -0.3425000      -2.596400    
 H   -3.459000     -0.4059000      -3.104400    
 H   -2.710800       1.170500      -2.721100    
 H   -2.503100      0.9395000       2.819000    
 H   -3.165400     -0.6942000       3.111900    
 H   -1.530100     -0.5169000       2.470800    
 H   -5.700000     -0.2326000      -2.405900    
 H   -5.475200     -0.4419000       2.640700    
 H    3.695700       1.830900     -0.1352000    
 H    1.905400      -2.798900     -0.3244000    
 H    4.289400      -2.480700     -0.3942000    
 H    6.169600      -1.976200      -1.146500    
 H    7.483600     -0.9150000     -0.7708000    
 H    7.135400       1.242600     -0.7910000    
 H    5.576800       1.971100     -0.8460000    
 H   -7.769900     -0.5423000      -1.029400    
 H   -7.660400     -0.6445000       1.432000    
 H    7.187100      -1.166000       1.651300    
 H    5.756200      -2.170400       1.429700    
 H    7.334100      -2.742800      0.8805000    
 H    5.473200       1.618300       1.747900    
 H    7.147100       1.054300       1.643700    
 H    6.747300       2.704700       1.175500    


%chk=000161887-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000161887

1 1
O 1.143360 1.508556 -0.574648
O -0.933694 2.482682 -0.701360
N -3.203719 0.407318 -1.040357
N -3.015621 -0.529342 0.981298
N 5.624845 -0.286616 -0.323491
C -2.301819 0.000318 -0.080937
C -4.516261 0.154565 -0.585835
C -4.396179 -0.459850 0.692598
C -0.849015 0.110620 -0.162616
C 1.409752 -0.861561 0.037343
C -0.000810 -0.980750 0.104163
C -2.867852 0.984815 -2.354312
C -2.467805 -0.977621 2.272414
C 1.978529 0.410650 -0.316388
C -5.774161 0.395306 -1.173596
C -5.525986 -0.860588 1.432909
C 4.263897 -0.457717 -0.185182
C -0.294339 1.430150 -0.494659
C 3.349113 0.624957 -0.422238
C 2.331020 -1.931893 0.283494
C 3.702763 -1.745382 0.186474
C 6.581514 -1.394106 -0.045444
C 6.200133 1.038237 -0.687807
C -6.906182 -0.004218 -0.434195
C -6.784957 -0.620602 0.845029
C 6.883474 -1.604460 1.455562
C 6.319481 2.021933 0.498517
H -0.436090 -1.960369 0.337923
H -1.915997 0.561403 -2.710685
H -3.661691 0.722975 -3.070417
H -2.758676 2.077723 -2.272790
H -3.080839 -0.560889 3.088036
H -2.472595 -2.078849 2.342576
H -1.438037 -0.608857 2.384755
H -5.880208 0.878026 -2.148837
H -5.442391 -1.337476 2.413474
H 3.688064 1.627163 -0.687302
H 1.938498 -2.918053 0.556416
H 4.362405 -2.590126 0.392434
H 6.198515 -2.326330 -0.498651
H 7.517034 -1.155388 -0.579338
H 7.200017 0.852609 -1.115678
H 5.593956 1.481501 -1.498885
H -7.903508 0.165869 -0.850648
H -7.691483 -0.913260 1.383216
H 7.352221 -0.709726 1.899074
H 5.968318 -1.829841 2.030166
H 7.582812 -2.450596 1.579092
H 5.340074 2.221686 0.966202
H 6.996747 1.630688 1.276617
H 6.730070 2.983615 0.142711


