COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.065  -0.813   0.258  1.00  0.00           N  
HETATM    2  C   UNL     1       4.909  -0.032  -0.308  1.00  0.00           C  
HETATM    3  C   UNL     1       4.601  -1.066  -1.138  1.00  0.00           C  
HETATM    4  C   UNL     1       3.277  -1.527  -1.209  1.00  0.00           C  
HETATM    5  C   UNL     1       2.902  -2.590  -2.047  1.00  0.00           C  
HETATM    6  C   UNL     1       0.697  -2.435  -1.358  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.202  -1.500   0.486  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.426  -1.366   2.528  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.140   1.136  -0.148  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.082   1.827  -1.155  1.00  0.00           C  
HETATM   11  C   UNL     1       2.282  -0.904  -0.412  1.00  0.00           C  
HETATM   12  C   UNL     1       2.634   0.157   0.431  1.00  0.00           C  
HETATM   13 CL   UNL     1      -2.220   2.839  -2.272  1.00  0.00          Cl  
HETATM   14  C   UNL     1      -4.455   1.943  -1.035  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.394   0.905  -0.388  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.073   0.093   0.505  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.450   0.208   0.623  1.00  0.00           C  
HETATM   18  N   UNL     1      -5.164  -0.607   1.510  1.00  0.00           N  
HETATM   19  C   UNL     1      -3.208  -2.004   1.846  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.292  -0.894   1.332  1.00  0.00           C  
HETATM   21  O   UNL     1      -1.348  -2.606   0.009  1.00  0.00           O  
HETATM   22  C   UNL     1       0.957  -1.386  -0.502  1.00  0.00           C  
HETATM   23  N   UNL     1       1.654  -2.991  -2.086  1.00  0.00           N  
HETATM   24  C   UNL     1       3.930   0.578   0.474  1.00  0.00           C  
HETATM   25  C   UNL     1       4.310   1.716   1.385  1.00  0.00           C  
HETATM   26  O   UNL     1       3.199   2.603   1.530  1.00  0.00           O  
HETATM   27  C   UNL     1       4.703   1.162   2.757  1.00  0.00           C  
HETATM   28  C   UNL     1       5.495   2.477   0.785  1.00  0.00           C  
HETATM   29  H   UNL     1       0.042   0.081   0.619  1.00  0.00           H  
HETATM   30  H   UNL     1       5.928   0.319  -0.251  1.00  0.00           H  
HETATM   31  H   UNL     1       5.370  -1.529  -1.739  1.00  0.00           H  
HETATM   32  H   UNL     1       3.644  -3.077  -2.662  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.312  -2.814  -1.436  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.095  -0.696   3.321  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.066  -2.144   2.945  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.212   1.226  -0.053  1.00  0.00           H  
HETATM   37  H   UNL     1       1.885   0.639   1.042  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.991   2.664  -1.634  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.322   0.817  -0.485  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.130  -0.669   1.453  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.668  -2.620   2.566  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.539  -2.621   1.011  1.00  0.00           H  
HETATM   43  H   UNL     1      -1.844  -0.375   2.179  1.00  0.00           H  
HETATM   44  H   UNL     1       2.896   2.992   0.699  1.00  0.00           H  
HETATM   45  H   UNL     1       5.550   0.486   2.646  1.00  0.00           H  
HETATM   46  H   UNL     1       4.978   1.985   3.416  1.00  0.00           H  
HETATM   47  H   UNL     1       3.859   0.621   3.184  1.00  0.00           H  
HETATM   48  H   UNL     1       5.215   2.871  -0.192  1.00  0.00           H  
HETATM   49  H   UNL     1       5.770   3.300   1.444  1.00  0.00           H  
HETATM   50  H   UNL     1       6.342   1.800   0.674  1.00  0.00           H  
CONECT    1   22    7   29                                            
CONECT    2    3   24   24   30                                       
CONECT    3    4    4    2   31                                       
CONECT    4    5    3    3   11                                       
CONECT    5   23   23    4   32                                       
CONECT    6   23   22   22   33                                       
CONECT    7    1   20   21   21                                       
CONECT    8   19   18   34   35                                       
CONECT    9   17   17   14   36                                       
CONECT   10   15   13   14   14                                       
CONECT   11    4   22   12   12                                       
CONECT   12   11   11   24   37                                       
CONECT   13   10                                                      
CONECT   14   10   10    9   38                                       
CONECT   15   16   16   10   39                                       
CONECT   16   20   15   15   17                                       
CONECT   17   16   18    9    9                                       
CONECT   18    8   17   40                                            
CONECT   19   20    8   41   42                                       
CONECT   20    7   19   16   43                                       
CONECT   21    7    7                                                 
CONECT   22    6    6   11    1                                       
CONECT   23    5    5    6                                            
CONECT   24    2    2   12   25                                       
CONECT   25   27   24   26   28                                       
CONECT   26   25   44                                                 
CONECT   27   25   45   46   47                                       
CONECT   28   25   48   49   50                                       
CONECT   29    1                                                      
CONECT   30    2                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   12                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   19                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   28                                                      
MASTER        0    0    0    0    0    0    0    0   50    0   50    0
END
