COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.598   2.590   0.091  1.00  0.00           N  
HETATM    2  C   UNL     1       0.742  -1.439  -0.537  1.00  0.00           C  
HETATM    3  C   UNL     1       4.488  -2.302  -0.345  1.00  0.00           C  
HETATM    4  C   UNL     1       4.488   0.345   0.235  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.242   0.820  -0.193  1.00  0.00           C  
HETATM    6  C   UNL     1       2.254   1.986   0.114  1.00  0.00           C  
HETATM    7  C   UNL     1       1.123   2.770   0.192  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.356   3.026   0.124  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.234  -1.640  -1.426  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.059  -2.234  -0.190  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.793  -2.335   0.356  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.145  -1.152  -2.123  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.876  -1.255  -1.586  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.697  -1.840  -0.340  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.392   4.428   0.255  1.00  0.00           C  
HETATM   16  C   UNL     1       1.995  -2.194  -0.094  1.00  0.00           C  
HETATM   17  C   UNL     1       3.225  -1.521  -0.718  1.00  0.00           C  
HETATM   18  C   UNL     1       5.778  -0.304  -0.196  1.00  0.00           C  
HETATM   19  C   UNL     1       2.143   0.618  -0.117  1.00  0.00           C  
HETATM   20  C   UNL     1       0.895   0.036  -0.274  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.688   4.806   0.298  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.134   2.188   0.039  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.414  -1.946   0.206  1.00  0.00           N  
HETATM   24  N   UNL     1       3.309  -0.155  -0.184  1.00  0.00           N  
HETATM   25  N   UNL     1      -3.450   3.696   0.199  1.00  0.00           N  
HETATM   26  O   UNL     1       4.511   1.317   0.960  1.00  0.00           O  
HETATM   27 CL   UNL     1      -2.574  -3.080   1.909  1.00  0.00          Cl  
HETATM   28  H   UNL     1       0.583  -1.600  -1.603  1.00  0.00           H  
HETATM   29  H   UNL     1       4.374  -3.343  -0.646  1.00  0.00           H  
HETATM   30  H   UNL     1       5.347  -1.867  -0.855  1.00  0.00           H  
HETATM   31  H   UNL     1       4.641  -2.250   0.733  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.216   0.369  -0.312  1.00  0.00           H  
HETATM   33  H   UNL     1       3.229   2.435   0.233  1.00  0.00           H  
HETATM   34  H   UNL     1       1.211   3.831   0.372  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.224  -1.562  -1.851  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.911  -2.618   0.350  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.286  -0.689  -3.089  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.026  -0.869  -2.130  1.00  0.00           H  
HETATM   39  H   UNL     1      -0.535   5.083   0.312  1.00  0.00           H  
HETATM   40  H   UNL     1       2.075  -2.164   0.993  1.00  0.00           H  
HETATM   41  H   UNL     1       1.935  -3.230  -0.427  1.00  0.00           H  
HETATM   42  H   UNL     1       3.118  -1.489  -1.802  1.00  0.00           H  
HETATM   43  H   UNL     1       5.794  -0.393  -1.282  1.00  0.00           H  
HETATM   44  H   UNL     1       6.619   0.308   0.130  1.00  0.00           H  
HETATM   45  H   UNL     1       5.854  -1.294   0.252  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.050   5.819   0.395  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.291  -2.355   1.077  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.420   3.669   0.202  1.00  0.00           H  
CONECT    1    8    8   25                                            
CONECT    2   20   16   23   28                                       
CONECT    3   17   29   30   31                                       
CONECT    4   18   26   26   24                                       
CONECT    5   22   22   20   32                                       
CONECT    6    7    7   19   33                                       
CONECT    7    6    6   22   34                                       
CONECT    8   15   22    1    1                                       
CONECT    9   12   12   10   35                                       
CONECT   10   11   11    9   36                                       
CONECT   11   14   27   10   10                                       
CONECT   12   13    9    9   37                                       
CONECT   13   14   14   12   38                                       
CONECT   14   23   13   13   11                                       
CONECT   15    8   21   21   39                                       
CONECT   16   17    2   40   41                                       
CONECT   17    3   24   16   42                                       
CONECT   18    4   43   44   45                                       
CONECT   19    6   24   20   20                                       
CONECT   20   19   19    5    2                                       
CONECT   21   15   15   25   46                                       
CONECT   22    7    8    5    5                                       
CONECT   23    2   14   47                                            
CONECT   24    4   19   17                                            
CONECT   25   21    1   48                                            
CONECT   26    4    4                                                 
CONECT   27   11                                                      
CONECT   28    2                                                      
CONECT   29    3                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   15                                                      
CONECT   40   16                                                      
CONECT   41   16                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   18                                                      
CONECT   46   21                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
