%chk=000023787.chk
%nprocshared=4
%mem=3GB
#p opt=(loose) PBEPBE/SDD pop=(full,Hirshfeld, NPA) GFInput nosymm

000023787

1 1
 O  -0.7143000     -0.2850000     -0.6154000    
 N   -4.164400      0.7444000      0.3550000    
 C   -2.682500      0.9245000      5.8400001E-02
 C   -2.105700     -0.4240000     -0.3540000    
 C   -4.339700     -0.2978000       1.450100    
 C   -4.753800       2.069500      0.8166000    
 C   -4.881500      0.2817000     -0.9051000    
 C   -2.541500       1.969400      -1.036900    
 C   7.0299998E-02  -1.383300     -0.3806000    
 C    1.109700      -1.324100      0.5420000    
 C    1.397100     -6.8700001E-02   1.297300    
 C  -0.1889000      -2.558300      -1.079000    
 C    1.898400      -2.452100      0.7688000    
 C    2.381700      0.8514000      0.6054000    
 C   0.5998000      -3.686200     -0.8522000    
 C    1.643400      -3.633000      7.1500003E-02
 C    1.906500       1.811300     -0.2701000    
 C    3.733200      0.7107000      0.8653000    
 C    2.813000       2.658700     -0.9072000    
 C    4.639700       1.558200      0.2283000    
 C    4.179400       2.532300     -0.6580000    
 H   -2.193600       1.285300      0.9724000    
 H   -2.229800      -1.172200      0.4343000    
 H   -2.545500     -0.8066000      -1.278000    
 H   -3.653200     -6.8700001E-02   2.270400    
 H   -5.373300     -0.2465000       1.808200    
 H   -4.173300      -1.300400       1.048300    
 H   -4.867800       2.748900     -3.1399999E-02
 H   -5.749200       1.875500       1.229700    
 H   -4.108400       2.493500       1.591400    
 H   -4.811000       1.029000      -1.696700    
 H   -4.529400     -0.6998000      -1.224400    
 H   -5.941700      0.1793000     -0.6439000    
 H   -2.980000       2.939700     -0.7955000    
 H   -1.474900       2.179000      -1.187000    
 H   -2.901700       1.641200      -2.015600    
 H    1.777500     -0.3173000       2.298500    
 H   0.4677000      0.4778000       1.507800    
 H  -0.9919000      -2.612100      -1.808600    
 H    2.714800      -2.426800       1.485800    
 H   0.4027000      -4.605100      -1.396500    
 H    2.257700      -4.511200      0.2477000    
 H   0.8459000       1.926700     -0.4656000    
 H    4.101600     -4.3600000E-02   1.554100    
 H    2.454600       3.418400      -1.595600    
 H    5.703700       1.460100      0.4224000    
 H    4.885200       3.192500      -1.153600    


%chk=000023787-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000023787

1 1
O -0.639478 -0.854238 0.524967
N -3.804606 1.129998 0.351915
C -2.251670 0.841182 0.309329
C -1.954318 -0.636017 -0.058051
C -4.431812 0.409355 1.547499
C -4.046568 2.628783 0.539139
C -4.493746 0.677472 -0.933033
C -1.482008 1.793032 -0.614638
C 0.119330 -1.969746 0.064533
C 1.490054 -1.956920 0.440955
C 2.074358 -0.817234 1.262761
C -0.442745 -3.023230 -0.687075
C 2.281810 -3.054461 0.031081
C 2.088567 0.553432 0.578778
C 0.379031 -4.104346 -1.083615
C 1.742579 -4.121835 -0.725111
C 2.349441 0.686555 -0.809334
C 1.905568 1.730849 1.348756
C 2.426185 1.964060 -1.411445
C 1.986648 3.010346 0.752022
C 2.245654 3.132281 -0.633577
H -1.922475 0.990858 1.354872
H -2.685920 -1.355086 0.366209
H -1.922450 -0.770478 -1.158484
H -3.984539 0.800539 2.473777
H -5.516723 0.596793 1.548043
H -4.246327 -0.670710 1.476071
H -3.738393 3.168648 -0.365832
H -5.120857 2.788853 0.720412
H -3.463867 2.982778 1.402986
H -4.005548 1.153753 -1.795168
H -4.428948 -0.416489 -1.020254
H -5.551587 0.980454 -0.892799
H -1.473561 2.835902 -0.262103
H -0.430866 1.454809 -0.614711
H -1.837626 1.760042 -1.660541
H 3.115118 -1.086276 1.529764
H 1.524226 -0.724523 2.218922
H -1.504258 -3.032678 -0.956022
H 3.341783 -3.068891 0.310096
H -0.051678 -4.926632 -1.664124
H 2.381623 -4.956950 -1.027568
H 2.505579 -0.211898 -1.418122
H 1.721780 1.645059 2.427419
H 2.645662 2.048338 -2.481812
H 1.867846 3.908812 1.368466
H 2.326326 4.121853 -1.096551


