COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.264   0.353  -1.011  1.00  0.00           C  
HETATM    2  N   UNL     1       3.803   0.206  -0.976  1.00  0.00           N  
HETATM    3  C   UNL     1       3.239   1.498  -1.382  1.00  0.00           C  
HETATM    4  C   UNL     1       1.711   1.420  -1.377  1.00  0.00           C  
HETATM    5  C   UNL     1       1.257   0.359  -2.384  1.00  0.00           C  
HETATM    6  C   UNL     1       1.936  -0.970  -2.044  1.00  0.00           C  
HETATM    7  C   UNL     1       3.452  -0.768  -2.015  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.239   0.199  -2.307  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.850  -0.012  -1.082  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.123  -0.065   0.053  1.00  0.00           O  
HETATM   11  C   UNL     1      -0.685  -0.262   1.256  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.025  -0.417   1.420  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.877  -0.372   0.290  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.084  -0.508   0.400  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.248  -0.155  -1.023  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.013  -0.095  -2.194  1.00  0.00           C  
HETATM   17  O   UNL     1      -4.361  -0.239  -2.139  1.00  0.00           O  
HETATM   18  C   UNL     1      -2.383   0.110  -3.409  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.002   0.257  -3.463  1.00  0.00           C  
HETATM   20  O   UNL     1      -0.394   0.459  -4.660  1.00  0.00           O  
HETATM   21  C   UNL     1       0.186  -0.312   2.447  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.218   0.293   3.639  1.00  0.00           C  
HETATM   23 CL   UNL     1      -1.752   1.102   3.728  1.00  0.00          Cl  
HETATM   24  C   UNL     1       0.599   0.237   4.750  1.00  0.00           C  
HETATM   25  C   UNL     1       1.821  -0.406   4.681  1.00  0.00           C  
HETATM   26  C   UNL     1       2.230  -1.004   3.501  1.00  0.00           C  
HETATM   27  C   UNL     1       1.421  -0.961   2.385  1.00  0.00           C  
HETATM   28  O   UNL     1       1.489  -1.422  -0.765  1.00  0.00           O  
HETATM   29  H   UNL     1       5.576   1.062  -0.244  1.00  0.00           H  
HETATM   30  H   UNL     1       5.731  -0.613  -0.824  1.00  0.00           H  
HETATM   31  H   UNL     1       5.569   0.720  -1.991  1.00  0.00           H  
HETATM   32  H   UNL     1       3.565   2.270  -0.685  1.00  0.00           H  
HETATM   33  H   UNL     1       3.586   1.746  -2.385  1.00  0.00           H  
HETATM   34  H   UNL     1       1.364   1.149  -0.380  1.00  0.00           H  
HETATM   35  H   UNL     1       1.296   2.389  -1.656  1.00  0.00           H  
HETATM   36  H   UNL     1       1.540   0.667  -3.390  1.00  0.00           H  
HETATM   37  H   UNL     1       1.683  -1.712  -2.802  1.00  0.00           H  
HETATM   38  H   UNL     1       3.788  -0.401  -2.984  1.00  0.00           H  
HETATM   39  H   UNL     1       3.941  -1.718  -1.799  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.438  -0.574   2.406  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.545  -1.183  -2.234  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.966   0.157  -4.316  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.176  -0.413  -5.014  1.00  0.00           H  
HETATM   44  H   UNL     1       0.286   0.700   5.674  1.00  0.00           H  
HETATM   45  H   UNL     1       2.459  -0.444   5.552  1.00  0.00           H  
HETATM   46  H   UNL     1       3.186  -1.505   3.455  1.00  0.00           H  
HETATM   47  H   UNL     1       1.742  -1.428   1.466  1.00  0.00           H  
HETATM   48  H   UNL     1       1.939  -2.260  -0.591  1.00  0.00           H  
CONECT    1    2   29   30   31                                       
CONECT    2    1    3    7                                            
CONECT    3    2    4   32   33                                       
CONECT    4    3    5   34   35                                       
CONECT    5    4    6    8   36                                       
CONECT    6    5    7   28   37                                       
CONECT    7    2    6   38   39                                       
CONECT    8    5    9    9   19                                       
CONECT    9    8    8   10   15                                       
CONECT   10    9   11                                                 
CONECT   11   10   12   12   21                                       
CONECT   12   11   11   13   40                                       
CONECT   13   12   14   14   15                                       
CONECT   14   13   13                                                 
CONECT   15    9   13   16   16                                       
CONECT   16   15   15   17   18                                       
CONECT   17   16   41                                                 
CONECT   18   16   19   19   42                                       
CONECT   19    8   18   18   20                                       
CONECT   20   19   43                                                 
CONECT   21   11   22   22   27                                       
CONECT   22   21   21   23   24                                       
CONECT   23   22                                                      
CONECT   24   22   25   25   44                                       
CONECT   25   24   24   26   45                                       
CONECT   26   25   27   27   46                                       
CONECT   27   21   26   26   47                                       
CONECT   28    6   48                                                 
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    4                                                      
CONECT   35    4                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40   12                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   20                                                      
CONECT   44   24                                                      
CONECT   45   25                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
