%chk=000050473.chk
%nprocshared=4
%mem=7GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000050473

0 1
 N   -2.013800       1.946400      0.3902000    
 C   -3.125300       1.331400     -0.3472000    
 C   -3.263900     -0.1506000      3.9700001E-02
 C   -1.946200     -0.8836000      4.4999998E-03
 C  -0.7362000     -0.1680000      2.5900001E-02
 C  -0.7370000       1.340300     -5.7000001E-03
 C   0.4788000     -0.8660000      1.5000000E-02
 C   -4.413300       2.092000     -3.9500002E-02
 C   -1.923300      -2.284300      9.7000003E-03
 C   0.4912000      -2.260700      9.9999998E-03
 C    1.757400     -0.1795000     -2.2000000E-03
 C  -0.7083000      -2.969000      9.7000003E-03
 C    2.349500      0.1525000      -1.218300    
 C    2.386200      0.1443000       1.197400    
 C    3.578300      0.8124000      -1.234800    
 C    3.615000      0.8042000       1.180900    
 C    4.211000       1.138200     -3.5200000E-02
 H   -2.932700       1.416700      -1.425200    
 H   -3.970200     -0.6332000     -0.6472000    
 H   -3.671400     -0.2419000       1.055100    
 H   1.8400000E-02   1.743600      0.6763000    
 H  -0.4813000       1.677400      -1.017700    
 H   -2.156000       1.810700       1.391500    
 H   -4.326000       3.144000     -0.3330000    
 H   -5.255800       1.661100     -0.5910000    
 H   -4.658100       2.058700       1.028200    
 H   -2.852500      -2.848400      1.3500000E-02
 H    1.427600      -2.814300      4.1000000E-03
 H  -0.6979000      -4.055000      9.2000002E-03
 H    1.868800     -9.3699999E-02  -2.162000    
 H    1.934400     -0.1084000       2.153600    
 H    4.042300       1.072900      -2.181600    
 H    4.107600       1.058300       2.114800    
 H    5.167700       1.652200     -4.8000000E-02


%chk=000050473-Freq.chk
%nprocshared=4
%mem=7GB
#p freq=noraman PBEPBE/SDD

000050473

0 1
N -2.107453 1.990919 0.166709
C -3.244601 1.302156 -0.499128
C -3.332617 -0.186677 -0.068885
C -1.971791 -0.881280 0.023447
C -0.750863 -0.148513 -0.029782
C -0.808690 1.380659 -0.192641
C 0.494053 -0.840557 0.111535
C -4.555498 2.056438 -0.225061
C -1.940630 -2.286327 0.209365
C 0.491568 -2.245765 0.316635
C 1.819705 -0.141204 0.068822
C -0.717717 -2.969737 0.358745
C 2.186858 0.714804 -1.005070
C 2.773174 -0.367861 1.099895
C 3.458026 1.328526 -1.044012
C 4.043705 0.247574 1.065521
C 4.392206 1.100659 -0.007207
H -3.028614 1.342143 -1.587097
H -3.988034 -0.747524 -0.765093
H -3.827550 -0.235392 0.925179
H -0.011471 1.857219 0.405328
H -0.602669 1.650747 -1.248220
H -2.244133 2.018325 1.189365
H -4.482756 3.096333 -0.586276
H -5.410267 1.564285 -0.724318
H -4.770791 2.084286 0.861426
H -2.887146 -2.841090 0.240644
H 1.448918 -2.770123 0.414816
H -0.704024 -4.056054 0.500076
H 1.483957 0.878115 -1.829236
H 2.503267 -1.016795 1.941210
H 3.720791 1.978457 -1.886356
H 4.758518 0.064939 1.875991
H 5.377570 1.579015 -0.035627


