%chk=000127412.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000127412

1 1
 N   -1.812700       1.462800       0.000000    
 N    4.148100     -0.7124000      1.9999999E-04
 C  -0.6575000     -0.4427000      3.0000001E-04
 C  -0.5389000      0.9448000      1.9999999E-04
 C   -2.054600     -0.7530000      9.9999997E-05
 C   0.5197000      -1.219800      5.0000002E-04
 C   0.6982000       1.600800      9.9999997E-05
 C   -2.749400      0.4566000       0.000000    
 C    1.777100     -0.5877000      3.0000001E-04
 C    1.866900      0.8200000      1.9999999E-04
 C    2.959600      -1.329100      1.9999999E-04
 C   0.4400000      -2.718700      8.9999998E-04
 C   -2.153300       2.872100      9.9999997E-05
 C   0.7846000       3.097500     -6.0000003E-04
 C   -2.793100      -1.955000     -1.9999999E-04
 C    3.132300       1.419200      3.0000001E-04
 C   -4.147200      0.5270000     -3.0000001E-04
 C    4.266200      0.6196000      3.0000001E-04
 C   -4.191500      -1.900900     -5.0000002E-04
 C   -4.856500     -0.6771000     -3.9999999E-04
 C    5.362300      -1.524100     -1.8000000E-03
 H    3.024200      -2.406700     -2.8999999E-02
 H    1.293200      -3.215600      0.4664000    
 H  -0.3943000      -3.062500      0.6145000    
 H   0.3218000      -3.093500      -1.020200    
 H   -3.219000       3.008000      0.1923000    
 H   -1.627600       3.375700      0.8117000    
 H   -1.932900       3.286300     -0.9856000    
 H   0.5708000       3.490800      0.9978000    
 H    1.744000       3.511100     -0.3102000    
 H   0.1097000       3.532700     -0.7388000    
 H   -2.323900      -2.931200     -2.4300000E-02
 H    3.310700       2.486100      2.3900000E-02
 H   -4.686000       1.467600     -5.2999998E-03
 H    5.265300       1.038500      1.4000000E-03
 H   -4.764000      -2.824600     -6.6000000E-03
 H   -5.943300     -0.6571000     -3.0000000E-03
 H    5.244900      -2.334900      0.7231000    
 H    5.494100      -1.922800      -1.011300    
 H    6.227700     -0.9193000      0.2810000    


%chk=000127412-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000127412

1 1
N -1.831222 1.521094 0.026921
N 4.222713 -0.747148 0.077114
C -0.633891 -0.461104 -0.027331
C -0.535962 1.004176 -0.025974
C -2.057033 -0.794196 -0.029903
C 0.506872 -1.276376 -0.020664
C 0.707089 1.683757 -0.102661
C -2.764965 0.450120 -0.001776
C 1.787085 -0.605776 0.003753
C 1.871580 0.863661 -0.044013
C 2.994282 -1.339450 0.059074
C 0.358229 -2.783985 -0.031421
C -2.266062 2.916096 0.212624
C 0.834540 3.188415 -0.288937
C -2.797714 -2.003534 -0.047853
C 3.197197 1.428919 -0.022493
C -4.170555 0.521098 0.000928
C 4.330857 0.644534 0.038715
C -4.206957 -1.944956 -0.041842
C -4.884256 -0.697811 -0.019506
C 5.469253 -1.558520 0.141868
H 2.998920 -2.428794 0.093830
H 1.310674 -3.333447 -0.034904
H -0.210510 -3.126328 0.852552
H -0.202231 -3.109806 -0.926703
H -3.213555 2.917482 0.774663
H -1.531384 3.475314 0.806968
H -2.430092 3.428932 -0.751981
H 0.937958 3.728723 0.671500
H 1.715115 3.439672 -0.902513
H -0.031315 3.606937 -0.820831
H -2.305547 -2.977736 -0.068221
H 3.337256 2.510924 -0.033784
H -4.708600 1.473233 0.002630
H 5.341732 1.053857 0.065948
H -4.787446 -2.872336 -0.058808
H -5.978813 -0.678029 -0.023034
H 5.216362 -2.628485 0.162216
H 6.093326 -1.354563 -0.743523
H 6.032769 -1.306062 1.055072


