%chk=000031964.chk
%nprocshared=8
%mem=21GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000031964

0 1
 N   -3.385100     -0.9214000      0.1592000    
 C   0.7450000     -0.1626000     -0.9472000    
 C  -0.5900000     -0.8730000     -0.6745000    
 C   0.6747000       1.324800     -0.6452000    
 C    1.925400     -0.9488000     -0.3842000    
 C   -1.711200     -0.2627000      -1.505700    
 C   0.6728000       1.842700      0.6595000    
 C    2.551900     -0.7516000      0.8623000    
 C   0.8387000      0.9459000       1.852800    
 C    2.224700      0.3189000       1.879500    
 C   -3.028100     -0.9946000      -1.252700    
 C   0.5521000       2.223700      -1.724200    
 C    2.397300      -2.003100      -1.207000    
 C   0.5524000       3.230100      0.8584000    
 C    3.642100      -1.584800       1.212900    
 C   -4.646600      -1.621100      0.4087000    
 C   -3.483200      0.4728000      0.5944000    
 C   0.4360000       3.597900      -1.515400    
 C    3.462800      -2.820000     -0.8336000    
 C   0.4345000       4.101700     -0.2218000    
 C    4.091000      -2.607200      0.3805000    
 C   -4.567100      -3.071600     -3.6100000E-02
 C   -3.790100      0.5640000       2.079600    
 H   0.8913000     -0.2141000      -2.037800    
 H  -0.5003000      -1.935900     -0.9375000    
 H  -0.8298000     -0.8567000      0.3902000    
 H   -1.823500      0.8155000      -1.372900    
 H   -1.465300     -0.3901000      -2.569000    
 H   4.9400002E-02  0.1928000       1.900700    
 H   0.7182000       1.538900       2.769100    
 H    2.988000       1.104500       1.794300    
 H    2.340900     -0.1241000       2.878600    
 H   -3.810400     -0.5618000      -1.889700    
 H   -2.876400      -2.029200      -1.578900    
 H   0.5389000       1.855900      -2.748200    
 H    1.923000      -2.196800      -2.168300    
 H   0.5568000       3.643300       1.864500    
 H    4.155800      -1.433900       2.161300    
 H   -4.864200      -1.652500       1.481200    
 H   -5.492900      -1.129900     -8.7899998E-02
 H   -2.532000      0.9995000      0.4843000    
 H   -4.237400       1.029200      2.3800001E-02
 H   0.3427000       4.270300      -2.362900    
 H    3.797500      -3.615100      -1.492700    
 H   0.3439000       5.170300     -5.2000001E-02
 H    4.926400      -3.230700      0.6833000    
 H   -4.619300      -3.179900      -1.123900    
 H   -3.657500      -3.560600      0.3294000    
 H   -5.420100      -3.626200      0.3715000    
 H   -4.831200      0.3170000       2.308800    
 H   -3.131200     -8.1699997E-02   2.670400    
 H   -3.631900       1.592300       2.424500    


%chk=000031964-Freq.chk
%nprocshared=8
%mem=21GB
#p freq=noraman PBEPBE/SDD

000031964

0 1
N -3.506613 -0.675067 0.040002
C 0.783699 -0.119386 -1.097650
C -0.593562 -0.863428 -0.958334
C 0.711677 1.338532 -0.635546
C 1.913473 -0.993614 -0.518824
C -1.754061 -0.189750 -1.718563
C 0.549808 1.711760 0.730721
C 2.405873 -0.979410 0.822069
C 0.604314 0.673392 1.838280
C 1.992087 -0.006087 1.930325
C -3.119108 -0.837870 -1.388582
C 0.743254 2.359745 -1.618901
C 2.465742 -1.941649 -1.427213
C 0.411314 3.082723 1.062035
C 3.416400 -1.915634 1.182838
C -4.425209 -1.746490 0.512887
C -4.022722 0.689634 0.338856
C 0.610664 3.725033 -1.280578
C 3.467056 -2.859030 -1.056022
C 0.436497 4.090608 0.071960
C 3.949966 -2.846637 0.271820
C -3.707982 -3.083967 0.779024
C -3.819845 1.098279 1.810592
H 0.977228 -0.075962 -2.189560
H -0.453375 -1.896574 -1.336042
H -0.888635 -0.958085 0.100568
H -1.784149 0.889003 -1.474303
H -1.586313 -0.256773 -2.814068
H -0.177208 -0.098252 1.714165
H 0.403453 1.170915 2.805960
H 2.756953 0.796228 1.992528
H 2.046844 -0.553136 2.892126
H -3.903786 -0.423046 -2.071412
H -3.055324 -1.921006 -1.604560
H 0.874180 2.076984 -2.671081
H 2.092787 -1.949329 -2.459741
H 0.288351 3.361568 2.116242
H 3.791120 -1.902644 2.214765
H -4.885262 -1.402942 1.457650
H -5.268242 -1.905233 -0.207961
H -3.477274 1.407358 -0.300038
H -5.104738 0.781827 0.063665
H 0.642320 4.490986 -2.063584
H 3.865750 -3.568591 -1.789598
H 0.327556 5.144053 0.353487
H 4.727715 -3.549416 0.590928
H -3.242671 -3.493435 -0.135694
H -2.910765 -2.943853 1.529888
H -4.423673 -3.838286 1.156648
H -4.333557 0.408618 2.504927
H -2.743903 1.093029 2.058397
H -4.218705 2.114606 1.988901


