%chk=000160928.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000160928

0 1
 N    3.679800     -1.8000000E-03  1.9200001E-02
 N   -1.900300      0.1692000      0.6208000    
 N   -2.457300     -0.1286000     -0.4620000    
 C    6.529300     -7.1900003E-02 -0.4328000    
 C    5.912700      0.8530000      0.6092000    
 C    5.666900      -1.316400     -0.6072000    
 C    4.469000       1.211600      0.2604000    
 C    4.226400     -0.9523000     -0.9597000    
 C    2.288300      4.1099999E-02  0.1690000    
 C    1.569900       1.227800     -7.4299999E-02
 C    1.567600      -1.101500      0.5673000    
 C   0.1837000       1.270400      7.5199999E-02
 C   0.1813000      -1.058800      0.7166000    
 C  -0.5105000      0.1272000      0.4706000    
 C   -3.854000     -8.6700000E-02 -0.3114000    
 C   -4.539600       1.098700     -0.5579000    
 C   -4.540900      -1.230600      8.3499998E-02
 C   -5.925800       1.140800     -0.4078000    
 C   -5.927100      -1.188500      0.2335000    
 C   -6.619500     -2.7000001E-03 -1.2200000E-02
 H    6.619800      0.4548000      -1.390400    
 H    7.540300     -0.3597000     -0.1241000    
 H    5.937800      0.3590000       1.588800    
 H    6.510200       1.767400      0.6958000    
 H    6.089500      -1.954600      -1.391100    
 H    5.678600      -1.898000      0.3233000    
 H    4.054200       1.787400       1.097100    
 H    4.451900       1.850400     -0.6314000    
 H    4.185800     -0.5026000      -1.959800    
 H    3.641700      -1.878500      -1.000500    
 H    2.075000       2.134700     -0.3974000    
 H    2.087100      -2.033700      0.7778000    
 H  -0.3471000       2.198300     -0.1210000    
 H  -0.3506000      -1.953900       1.028600    
 H   -4.007000       1.994100     -0.8672000    
 H   -4.009300      -2.158600      0.2764000    
 H   -6.464900       2.063900     -0.5993000    
 H   -6.467400      -2.078900      0.5413000    
 H   -7.698800      3.0099999E-02  0.1044000    


%chk=000160928-Freq.chk
%nprocshared=12
%mem=21GB
#p freq=noraman PBEPBE/SDD

000160928

0 1
N 3.766949 -0.042781 -0.282358
N -1.897487 -0.539702 0.059081
N -2.635625 0.545089 -0.040493
C 6.699954 0.034653 -0.022594
C 5.800577 1.169013 0.514647
C 5.921463 -1.299907 -0.010995
C 4.463265 1.261808 -0.259255
C 4.603050 -1.152671 -0.799520
C 2.367703 -0.136740 -0.220853
C 1.529436 1.026024 -0.338293
C 1.715266 -1.397515 -0.013837
C 0.136405 0.934496 -0.248368
C 0.320267 -1.482178 0.072009
C -0.499894 -0.324946 -0.040393
C -4.045236 0.306848 0.058903
C -4.865610 1.460902 -0.058568
C -4.648104 -0.968695 0.261801
C -6.269443 1.347685 0.023461
C -6.049331 -1.072849 0.343227
C -6.866820 0.080802 0.224460
H 7.013209 0.267764 -1.061530
H 7.622309 -0.044463 0.582091
H 5.578666 0.986550 1.584062
H 6.317193 2.145383 0.444760
H 6.525013 -2.109781 -0.463381
H 5.693726 -1.592422 1.032259
H 3.821287 2.007420 0.235558
H 4.658145 1.615784 -1.298520
H 4.847725 -0.946158 -1.867957
H 4.032897 -2.092144 -0.778785
H 1.974411 2.004296 -0.541685
H 2.303948 -2.309760 0.117808
H -0.493062 1.823632 -0.355396
H -0.172177 -2.445527 0.243309
H -4.376462 2.428553 -0.213558
H -3.999483 -1.845577 0.350563
H -6.896127 2.241785 -0.068657
H -6.514184 -2.053347 0.499790
H -7.957118 -0.009727 0.288507


