%chk=000163404.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000163404

0 1
 N   -4.376500      2.6200000E-02  3.9500002E-02
 N    4.379800      2.2299999E-02 -4.5200001E-02
 N   -5.963700      -2.648800      -2.027200    
 N   -6.556600       2.576800       1.678900    
 N    6.535000       2.594500      -1.682800    
 N    5.987800      -2.635100       2.027400    
 C  -0.5975000      1.3600000E-02  0.5131000    
 C   0.5746000     -1.6000000E-03 -0.4708000    
 C   -1.939800      4.8000002E-03 -0.2234000    
 C    1.944300     -2.4599999E-02  0.2149000    
 C   -3.108700      5.6299999E-02  0.7590000    
 C    3.112600      3.8400002E-02 -0.7685000    
 C   -4.683000      -1.333600     -0.4080000    
 C   -5.459000      0.5397000      0.8808000    
 C    5.458000      0.5465000     -0.8847000    
 C    4.698600      -1.333700      0.4040000    
 C   -5.671800      -1.294700      -1.569300    
 C   -5.466900       2.065200      0.8548000    
 C    5.449300       2.072000     -0.8604000    
 C    5.683700      -1.284200       1.568000    
 H  -0.5340000     -0.8604000       1.172300    
 H  -0.5281000      0.9049000       1.148400    
 H   0.4900000     -0.8783000      -1.125000    
 H   0.5111000      0.8829000      -1.116900    
 H   -1.990100      0.8709000     -0.8960000    
 H   -1.974400     -0.8881000     -0.8555000    
 H    2.007800      0.8305000      0.9010000    
 H    1.985800     -0.9242000      0.8374000    
 H   -2.998700      0.9805000       1.338000    
 H   -3.042700     -0.7665000       1.483500    
 H    3.053100     -0.7857000      -1.491800    
 H    2.992300      0.9614000      -1.346900    
 H   -3.788300      -1.856300     -0.7633000    
 H   -5.075000      -1.941600      0.4195000    
 H   -6.440500      0.2056000      0.5252000    
 H   -5.372200      0.1646000       1.910100    
 H    6.442200      0.2233000     -0.5266000    
 H    5.377500      0.1695000      -1.913800    
 H    3.808700      -1.865900      0.7571000    
 H    5.099000      -1.938200     -0.4220000    
 H   -5.253000     -0.7194000      -2.403500    
 H   -6.619400     -0.8253000      -1.291700    
 H   -5.595900       2.426400     -0.1723000    
 H   -4.530700       2.484000       1.235200    
 H    4.509500       2.480300      -1.243100    
 H    5.572300       2.435900      0.1665000    
 H    6.627300     -0.8055000       1.292300    
 H    5.257000     -0.7126000       2.400500    
 H   -6.578100      -2.605900      -2.839200    
 H   -5.105000      -3.097900      -2.343200    
 H   -6.585300       3.593100       1.608100    
 H   -7.448400       2.240700       1.317400    
 H    6.552500       3.611100      -1.613100    
 H    7.429600       2.268500      -1.319300    
 H    6.599800      -2.585600       2.840900    
 H    5.132800      -3.092400       2.341600    


%chk=000163404-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000163404

0 1
N -4.473654 -0.070836 0.165861
N 4.473581 -0.062753 -0.165605
N -6.174861 -2.713940 -1.974332
N -6.495567 2.892108 1.429502
N 6.489290 2.903874 -1.430442
N 6.179576 -2.700610 1.977246
C -0.589023 -0.095982 0.499714
C 0.589037 -0.095461 -0.500145
C -1.971669 -0.096163 -0.190422
C 1.971611 -0.092391 0.190175
C -3.140417 -0.040191 0.816532
C 3.140454 -0.035341 -0.816629
C -4.900181 -1.416945 -0.284351
C -5.515793 0.669723 0.917571
C 5.514395 0.679589 -0.917365
C 4.902809 -1.407608 0.285765
C -5.720351 -1.360520 -1.593289
C -5.483043 2.185750 0.618044
C 5.478099 2.195742 -0.618871
C 5.722149 -1.348488 1.595105
H -0.505936 -0.981553 1.164639
H -0.505870 0.793863 1.158848
H 0.507613 -0.981904 -1.164101
H 0.504345 0.793534 -1.160220
H -2.058293 0.771331 -0.873605
H -2.064129 -1.002338 -0.823650
H 2.056529 0.775982 0.872446
H 2.065625 -0.997742 0.824343
H -3.062054 0.903379 1.390235
H -3.027008 -0.868369 1.562814
H 3.028763 -0.864568 -1.561990
H 3.060446 0.907439 -1.391397
H -3.995127 -2.029761 -0.464405
H -5.503354 -1.957180 0.482652
H -6.508096 0.273719 0.623741
H -5.431980 0.528905 2.020718
H 6.507444 0.285989 -0.622813
H 5.431396 0.537840 -2.020455
H 3.999000 -2.022290 0.465724
H 5.507601 -1.947039 -0.480526
H -5.101767 -0.840995 -2.361667
H -6.617937 -0.734272 -1.429293
H -5.589785 2.318232 -0.484010
H -4.488230 2.585738 0.891697
H 4.482467 2.593273 -0.893136
H 5.584145 2.329192 0.483132
H 6.618369 -0.720271 1.431164
H 5.101980 -0.829895 2.362837
H -6.928435 -2.733013 -2.666834
H -5.414254 -3.354914 -2.221431
H -6.366724 3.905853 1.487893
H -7.462807 2.642916 1.199895
H 6.358109 3.917273 -1.489614
H 7.457017 2.657100 -1.200280
H 6.932859 -2.717519 2.670119
H 5.420333 -3.343191 2.224362


