COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.931   0.681  -0.991  1.00  0.00           C  
HETATM    2  C   UNL     1       2.378   0.426  -1.327  1.00  0.00           C  
HETATM    3  C   UNL     1       3.781   1.950   0.140  1.00  0.00           C  
HETATM    4  C   UNL     1       3.876   1.327   1.379  1.00  0.00           C  
HETATM    5  C   UNL     1       4.585   1.931   2.394  1.00  0.00           C  
HETATM    6  C   UNL     1       5.204   3.156   2.187  1.00  0.00           C  
HETATM    7  C   UNL     1       5.123   3.784   0.978  1.00  0.00           C  
HETATM    8  C   UNL     1       4.409   3.191  -0.071  1.00  0.00           C  
HETATM    9  N   UNL     1       3.435   2.681  -1.934  1.00  0.00           N  
HETATM   10  C   UNL     1       0.397  -1.539  -1.841  1.00  0.00           C  
HETATM   11  C   UNL     1       0.934  -2.498  -0.809  1.00  0.00           C  
HETATM   12  C   UNL     1       0.063  -3.268  -0.062  1.00  0.00           C  
HETATM   13  C   UNL     1       0.555  -4.148   0.884  1.00  0.00           C  
HETATM   14  C   UNL     1       1.918  -4.257   1.084  1.00  0.00           C  
HETATM   15  C   UNL     1       2.790  -3.486   0.337  1.00  0.00           C  
HETATM   16  C   UNL     1       2.298  -2.610  -0.614  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.309  -0.091  -0.771  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.228  -1.128  -0.872  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.530  -0.939  -0.461  1.00  0.00           C  
HETATM   20  C   UNL     1      -3.925   0.295   0.056  1.00  0.00           C  
HETATM   21  C   UNL     1      -5.324   0.501   0.499  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.612   0.742   1.833  1.00  0.00           C  
HETATM   23  C   UNL     1      -6.944   0.932   2.216  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.931   0.879   1.291  1.00  0.00           C  
HETATM   25  C   UNL     1      -6.387   0.461  -0.436  1.00  0.00           C  
HETATM   26  C   UNL     1      -3.000   1.334   0.157  1.00  0.00           C  
HETATM   27  C   UNL     1      -1.698   1.138  -0.250  1.00  0.00           C  
HETATM   28  O   UNL     1       0.592   1.758  -0.548  1.00  0.00           O  
HETATM   29  N   UNL     1       3.164   1.629  -1.046  1.00  0.00           N  
HETATM   30  N   UNL     1       4.156   3.566  -1.341  1.00  0.00           N  
HETATM   31  N   UNL     1       0.012  -0.285  -1.189  1.00  0.00           N  
HETATM   32 CL   UNL     1       4.503  -3.622   0.587  1.00  0.00          Cl  
HETATM   33  N   UNL     1      -7.654   0.644  -0.018  1.00  0.00           N  
HETATM   34  O   UNL     1      -6.157   0.256  -1.616  1.00  0.00           O  
HETATM   35  H   UNL     1       2.750  -0.401  -0.722  1.00  0.00           H  
HETATM   36  H   UNL     1       2.466   0.172  -2.383  1.00  0.00           H  
HETATM   37  H   UNL     1       3.395   0.374   1.546  1.00  0.00           H  
HETATM   38  H   UNL     1       4.659   1.448   3.357  1.00  0.00           H  
HETATM   39  H   UNL     1       5.756   3.618   2.992  1.00  0.00           H  
HETATM   40  H   UNL     1       5.609   4.737   0.830  1.00  0.00           H  
HETATM   41  H   UNL     1       1.166  -1.340  -2.587  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.474  -1.979  -2.326  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.002  -3.183  -0.218  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.126  -4.750   1.467  1.00  0.00           H  
HETATM   45  H   UNL     1       2.302  -4.944   1.824  1.00  0.00           H  
HETATM   46  H   UNL     1       2.979  -2.011  -1.201  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.922  -2.083  -1.272  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.244  -1.745  -0.540  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.820   0.781   2.566  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.185   1.120   3.252  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.956   1.027   1.598  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.303   2.291   0.557  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.980   1.941  -0.169  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.379   0.615  -0.662  1.00  0.00           H  
CONECT    1    2   31   28   28                                       
CONECT    2   29    1   35   36                                       
CONECT    3    4    4    8   29                                       
CONECT    4    5    3    3   37                                       
CONECT    5    6    6    4   38                                       
CONECT    6    5    5    7   39                                       
CONECT    7    6    8    8   40                                       
CONECT    8    7    7    3   30                                       
CONECT    9   29   30   30                                            
CONECT   10   31   11   41   42                                       
CONECT   11   10   12   12   16                                       
CONECT   12   11   11   13   43                                       
CONECT   13   12   14   14   44                                       
CONECT   14   13   13   15   45                                       
CONECT   15   16   16   14   32                                       
CONECT   16   11   15   15   46                                       
CONECT   17   18   31   27   27                                       
CONECT   18   19   19   17   47                                       
CONECT   19   18   18   20   48                                       
CONECT   20   19   21   26   26                                       
CONECT   21   25   20   22   22                                       
CONECT   22   21   21   23   49                                       
CONECT   23   24   24   22   50                                       
CONECT   24   33   23   23   51                                       
CONECT   25   34   34   33   21                                       
CONECT   26   20   20   27   52                                       
CONECT   27   17   17   26   53                                       
CONECT   28    1    1                                                 
CONECT   29    3    2    9                                            
CONECT   30    8    9    9                                            
CONECT   31   17    1   10                                            
CONECT   32   15                                                      
CONECT   33   25   24   54                                            
CONECT   34   25   25                                                 
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41   10                                                      
CONECT   42   10                                                      
CONECT   43   12                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   24                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   33                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
