COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.789  -0.328  -0.056  1.00  0.00           C  
HETATM    2  C   UNL     1       1.303  -1.714  -0.099  1.00  0.00           C  
HETATM    3  C   UNL     1       2.492  -3.525   0.939  1.00  0.00           C  
HETATM    4  C   UNL     1       1.567  -3.800  -1.259  1.00  0.00           C  
HETATM    5  C   UNL     1       1.085  -2.508  -1.225  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.555  -1.178  -0.120  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.787   2.270  -1.234  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.311   2.410  -1.276  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.785   3.151  -0.022  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.323   2.384   1.220  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.799   2.244   1.189  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.866  -2.816   0.515  1.00  0.00           C  
HETATM   13  C   UNL     1       3.885   1.684   0.046  1.00  0.00           C  
HETATM   14  C   UNL     1       3.361   2.974   0.085  1.00  0.00           C  
HETATM   15  C   UNL     1       2.015   3.185   0.079  1.00  0.00           C  
HETATM   16  C   UNL     1       1.137   2.090   0.031  1.00  0.00           C  
HETATM   17  C   UNL     1       1.673   0.780  -0.008  1.00  0.00           C  
HETATM   18  C   UNL     1       3.062   0.598   0.000  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.190   2.277   0.025  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.035   1.271  -0.024  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.586  -0.068  -0.066  1.00  0.00           C  
HETATM   22  C   UNL     1       2.015  -2.231   0.985  1.00  0.00           C  
HETATM   23  C   UNL     1       2.267  -4.309  -0.179  1.00  0.00           C  
HETATM   24  N   UNL     1      -2.396   1.529  -0.028  1.00  0.00           N  
HETATM   25 CL   UNL     1       5.606   1.457   0.056  1.00  0.00          Cl  
HETATM   26  N   UNL     1      -2.117  -1.641  -1.201  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.964  -2.694  -0.826  1.00  0.00           N  
HETATM   28  O   UNL     1      -1.999  -1.883   0.944  1.00  0.00           O  
HETATM   29  O   UNL     1      -3.454  -3.624   1.209  1.00  0.00           O  
HETATM   30  H   UNL     1       3.039  -3.928   1.778  1.00  0.00           H  
HETATM   31  H   UNL     1       1.399  -4.416  -2.130  1.00  0.00           H  
HETATM   32  H   UNL     1       0.539  -2.112  -2.069  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.448   1.731  -2.118  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.332   3.261  -1.215  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.600   2.974  -2.163  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.766   1.421  -1.308  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.360   4.155  -0.009  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.873   3.214  -0.027  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.621   2.928   2.116  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.778   1.393   1.227  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.343   3.235   1.196  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.468   1.686   2.065  1.00  0.00           H  
HETATM   43  H   UNL     1       4.031   3.820   0.122  1.00  0.00           H  
HETATM   44  H   UNL     1       1.625   4.191   0.110  1.00  0.00           H  
HETATM   45  H   UNL     1       3.478  -0.398  -0.030  1.00  0.00           H  
HETATM   46  H   UNL     1       2.191  -1.621   1.858  1.00  0.00           H  
HETATM   47  H   UNL     1       2.639  -5.322  -0.209  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.515  -3.231  -1.416  1.00  0.00           H  
CONECT    1   17   21   21    2                                       
CONECT    2    1   22   22    5                                       
CONECT    3   22   23   23   30                                       
CONECT    4   23    5    5   31                                       
CONECT    5    2    4    4   32                                       
CONECT    6   21   26   26   28                                       
CONECT    7   24    8   33   34                                       
CONECT    8    7    9   35   36                                       
CONECT    9    8   10   37   38                                       
CONECT   10    9   11   39   40                                       
CONECT   11   24   10   41   42                                       
CONECT   12   27   28   29   29                                       
CONECT   13   14   14   18   25                                       
CONECT   14   13   13   15   43                                       
CONECT   15   14   16   16   44                                       
CONECT   16   15   15   17   19                                       
CONECT   17   16   18   18    1                                       
CONECT   18   13   17   17   45                                       
CONECT   19   16   20   20                                            
CONECT   20   19   19   21   24                                       
CONECT   21   20    1    1    6                                       
CONECT   22    2    2    3   46                                       
CONECT   23    3    3    4   47                                       
CONECT   24   20    7   11                                            
CONECT   25   13                                                      
CONECT   26    6    6   27                                            
CONECT   27   26   12   48                                            
CONECT   28    6   12                                                 
CONECT   29   12   12                                                 
CONECT   30    3                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38    9                                                      
CONECT   39   10                                                      
CONECT   40   10                                                      
CONECT   41   11                                                      
CONECT   42   11                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   18                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
