COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.890  -0.561  -0.923  1.00  0.00           C  
HETATM    2  C   UNL     1       5.117   0.702  -0.536  1.00  0.00           C  
HETATM    3  C   UNL     1       2.883   3.813   0.112  1.00  0.00           C  
HETATM    4  C   UNL     1       3.465  -0.606   0.660  1.00  0.00           C  
HETATM    5  C   UNL     1       4.189  -1.908   0.309  1.00  0.00           C  
HETATM    6  C   UNL     1       2.944   1.527  -0.181  1.00  0.00           C  
HETATM    7  C   UNL     1       1.511   3.751   0.258  1.00  0.00           C  
HETATM    8  C   UNL     1       0.887   2.505   0.177  1.00  0.00           C  
HETATM    9  C   UNL     1       5.686  -1.628   0.156  1.00  0.00           C  
HETATM   10  C   UNL     1       6.824  -3.612   0.874  1.00  0.00           C  
HETATM   11  O   UNL     1       6.359  -2.829  -0.228  1.00  0.00           O  
HETATM   12  N   UNL     1       3.690   0.382  -0.402  1.00  0.00           N  
HETATM   13  N   UNL     1       3.562   2.696  -0.104  1.00  0.00           N  
HETATM   14  N   UNL     1       1.632   1.424  -0.036  1.00  0.00           N  
HETATM   15  N   UNL     1      -0.488   2.395   0.318  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.112   1.163   0.127  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.496   1.087   0.162  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.103  -0.146  -0.030  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.287  -1.274  -0.254  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.903  -1.108  -0.275  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.372   0.083  -0.092  1.00  0.00           N  
HETATM   22  N   UNL     1      -3.118  -2.336  -0.408  1.00  0.00           N  
HETATM   23  C   UNL     1      -4.354  -1.943  -0.296  1.00  0.00           C  
HETATM   24  N   UNL     1      -4.400  -0.601  -0.062  1.00  0.00           N  
HETATM   25  C   UNL     1      -5.608   0.207   0.121  1.00  0.00           C  
HETATM   26  C   UNL     1      -6.530   0.065  -1.107  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.536  -1.041  -0.702  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.786  -0.743   0.798  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.407  -0.307   1.332  1.00  0.00           C  
HETATM   30  H   UNL     1       5.522  -0.934  -1.879  1.00  0.00           H  
HETATM   31  H   UNL     1       6.951  -0.326  -1.007  1.00  0.00           H  
HETATM   32  H   UNL     1       5.495   1.083   0.413  1.00  0.00           H  
HETATM   33  H   UNL     1       5.249   1.459  -1.309  1.00  0.00           H  
HETATM   34  H   UNL     1       3.396   4.761   0.169  1.00  0.00           H  
HETATM   35  H   UNL     1       2.397  -0.799   0.756  1.00  0.00           H  
HETATM   36  H   UNL     1       3.851  -0.219   1.604  1.00  0.00           H  
HETATM   37  H   UNL     1       4.034  -2.636   1.106  1.00  0.00           H  
HETATM   38  H   UNL     1       3.794  -2.303  -0.627  1.00  0.00           H  
HETATM   39  H   UNL     1       0.933   4.648   0.430  1.00  0.00           H  
HETATM   40  H   UNL     1       6.089  -1.271   1.103  1.00  0.00           H  
HETATM   41  H   UNL     1       7.526  -3.025   1.466  1.00  0.00           H  
HETATM   42  H   UNL     1       5.978  -3.903   1.496  1.00  0.00           H  
HETATM   43  H   UNL     1       7.323  -4.506   0.499  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.015   3.175   0.550  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.091   1.972   0.337  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.263  -1.961  -0.445  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.217  -2.587  -0.377  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.339   1.253   0.268  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.052   1.002  -1.302  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.957  -0.243  -1.981  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.460  -0.952  -1.273  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.095  -2.030  -0.830  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.511   0.063   0.910  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.129  -1.640   1.313  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.895  -1.157   1.783  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.525   0.490   2.066  1.00  0.00           H  
CONECT    1    2    9   30   31                                       
CONECT    2    1   12   32   33                                       
CONECT    3   13   13    7   34                                       
CONECT    4   12    5   35   36                                       
CONECT    5    9    4   37   38                                       
CONECT    6   13   12   14   14                                       
CONECT    7    3    8    8   39                                       
CONECT    8    7    7   14   15                                       
CONECT    9    1   11    5   40                                       
CONECT   10   11   41   42   43                                       
CONECT   11   10    9                                                 
CONECT   12    2    6    4                                            
CONECT   13    3    3    6                                            
CONECT   14    6    6    8                                            
CONECT   15    8   16   44                                            
CONECT   16   15   17   17   21                                       
CONECT   17   16   16   18   45                                       
CONECT   18   17   24   19   19                                       
CONECT   19   18   18   20   22                                       
CONECT   20   21   21   19   46                                       
CONECT   21   16   20   20                                            
CONECT   22   19   23   23                                            
CONECT   23   24   22   22   47                                       
CONECT   24   25   18   23                                            
CONECT   25   26   24   29   48                                       
CONECT   26   27   25   49   50                                       
CONECT   27   26   28   51   52                                       
CONECT   28   27   29   53   54                                       
CONECT   29   25   28   55   56                                       
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    2                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    9                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   15                                                      
CONECT   45   17                                                      
CONECT   46   20                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
