%chk=000042677.chk
%nprocshared=8
%mem=31GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000042677

0 1
 N   -1.718400      -1.074600      0.7156000    
 N    1.722400      -1.073900     -0.7128000    
 C   -3.053400      -1.068800      0.1175000    
 C    3.052600      -1.068500     -0.1212000    
 C   -3.269700      0.1409000     -0.8091000    
 C    3.270800      0.1397000      0.8070000    
 C  -0.6927000      -1.062800     -0.3154000    
 C   0.6937000      -1.067700      0.3217000    
 C   -3.124000       1.488400     -9.6000001E-02
 C    3.122300       1.488400      9.6799999E-02
 C   -4.086500      -1.070700       1.243500    
 C    4.082600      -1.067700      -1.250100    
 C   -3.322300       2.649500      -1.058600    
 C    3.322700       2.647800       1.061000    
 H   -3.196000      -1.984300     -0.4711000    
 H    3.199600      -1.984300      0.4659000    
 H   -2.623900      9.7700000E-02  -1.692800    
 H   -4.290200      7.9000004E-02  -1.213000    
 H    2.628500      9.4700001E-02   1.693200    
 H    4.292600      7.7900000E-02   1.207300    
 H  -0.8026000      -1.936200     -0.9707000    
 H  -0.7440000     -0.1621000     -0.9349000    
 H   0.7487000     -0.1724000      0.9484000    
 H   0.8029000      -1.947300      0.9686000    
 H   -1.608700      -1.898500       1.306400    
 H    1.609700      -1.894100      -1.307900    
 H   -3.863700       1.585100      0.7053000    
 H   -2.132800       1.581400      0.3608000    
 H    3.859500       1.586800     -0.7065000    
 H    2.129600       1.581700     -0.3567000    
 H   -4.035200      -2.009800       1.807100    
 H   -3.930900     -0.2576000       1.960500    
 H   -5.102900     -0.9851000      0.8444000    
 H    4.030800      -2.006000      -1.815100    
 H    3.924500     -0.2537000      -1.965400    
 H    5.100000     -0.9818000     -0.8536000    
 H   -2.577900       2.624700      -1.860900    
 H   -4.318300       2.618000      -1.511900    
 H   -3.219700       3.602400     -0.5300000    
 H    2.580800       2.621200       1.865400    
 H    4.320100       2.616200       1.511300    
 H    3.218000       3.601600      0.5344000    


%chk=000042677-Freq.chk
%nprocshared=8
%mem=31GB
#p freq=noraman PBEPBE/SDD

000042677

0 1
N -1.817409 -1.019098 0.512151
N 1.817473 -1.018009 -0.514396
C -3.158206 -1.066716 -0.129890
C 3.158372 -1.066912 0.127336
C -3.503835 0.283102 -0.819673
C 3.504364 0.281732 0.819225
C -0.658056 -0.987346 -0.400810
C 0.658190 -0.988128 0.398709
C -3.529764 1.509565 0.119486
C 3.529167 1.509893 -0.117743
C -4.201892 -1.461677 0.936021
C 4.201755 -1.460282 -0.939461
C -3.729287 2.832746 -0.650800
C 3.728927 2.831727 0.654788
H -3.180502 -1.849268 -0.934469
H 3.180730 -1.850806 0.930599
H -2.772319 0.471706 -1.632083
H -4.488887 0.168900 -1.317968
H 2.773468 0.468752 1.632552
H 4.489842 0.166855 1.316529
H -0.653265 -1.850710 -1.120457
H -0.694746 -0.067891 -1.011792
H 0.694865 -0.069908 1.011546
H 0.653456 -1.852944 1.116614
H -1.717503 -1.774489 1.205821
H 1.717474 -1.771926 -1.209645
H -4.341690 1.395887 0.864762
H -2.582039 1.534076 0.689795
H 4.340521 1.397827 -0.863887
H 2.580932 1.535175 -0.687187
H -4.009746 -2.482030 1.320804
H -4.170258 -0.763025 1.790535
H -5.220717 -1.448607 0.509548
H 4.009545 -2.480081 -1.325671
H 4.169800 -0.760374 -1.792934
H 5.220716 -1.447759 -0.513298
H -2.907610 2.998679 -1.373621
H -4.678378 2.826018 -1.220846
H -3.754260 3.699997 0.034892
H 2.907814 2.996071 1.378616
H 4.678500 2.824227 1.224022
H 3.753055 3.700252 -0.029318


