COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -0.515  -2.100  -1.188  1.00  0.00           O  
HETATM    2  C   UNL     1      -0.532  -1.008  -0.654  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.820  -0.330  -0.400  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.026  -0.955  -0.779  1.00  0.00           C  
HETATM    5  O   UNL     1      -2.992  -2.174  -1.374  1.00  0.00           O  
HETATM    6  C   UNL     1      -4.247  -2.755  -1.735  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.228  -0.347  -0.553  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.270   0.912   0.062  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.835   0.912   0.214  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.060   1.548   0.446  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.139   2.813   1.061  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.366   3.369   1.259  1.00  0.00           C  
HETATM   13  N   UNL     1      -5.482   2.753   0.891  1.00  0.00           N  
HETATM   14  C   UNL     1      -5.486   1.574   0.313  1.00  0.00           C  
HETATM   15 CL   UNL     1      -6.989   0.833  -0.139  1.00  0.00          Cl  
HETATM   16  N   UNL     1       0.623  -0.418  -0.289  1.00  0.00           N  
HETATM   17  C   UNL     1       1.900  -1.092  -0.535  1.00  0.00           C  
HETATM   18  C   UNL     1       2.198  -2.055   0.616  1.00  0.00           C  
HETATM   19  N   UNL     1       3.473  -2.777   0.370  1.00  0.00           N  
HETATM   20  C   UNL     1       3.370  -3.996   1.212  1.00  0.00           C  
HETATM   21  C   UNL     1       1.899  -4.443   1.072  1.00  0.00           C  
HETATM   22  O   UNL     1       1.415  -4.953   2.316  1.00  0.00           O  
HETATM   23  C   UNL     1       1.128  -3.166   0.680  1.00  0.00           C  
HETATM   24  C   UNL     1       3.000  -0.067  -0.630  1.00  0.00           C  
HETATM   25  C   UNL     1       3.998  -0.213  -1.578  1.00  0.00           C  
HETATM   26  C   UNL     1       5.008   0.721  -1.671  1.00  0.00           C  
HETATM   27  C   UNL     1       5.023   1.818  -0.806  1.00  0.00           C  
HETATM   28  C   UNL     1       6.069   2.792  -0.897  1.00  0.00           C  
HETATM   29  N   UNL     1       6.898   3.565  -0.969  1.00  0.00           N  
HETATM   30  C   UNL     1       4.012   1.960   0.148  1.00  0.00           C  
HETATM   31 CL   UNL     1       4.020   3.319   1.229  1.00  0.00          Cl  
HETATM   32  C   UNL     1       3.004   1.019   0.226  1.00  0.00           C  
HETATM   33  H   UNL     1      -4.762  -2.100  -2.437  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.077  -3.726  -2.200  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.858  -2.882  -0.841  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.145  -0.836  -0.848  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.910   1.387   0.507  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.244   3.333   1.369  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.433   4.339   1.730  1.00  0.00           H  
HETATM   40  H   UNL     1       0.609   0.454   0.137  1.00  0.00           H  
HETATM   41  H   UNL     1       1.842  -1.650  -1.470  1.00  0.00           H  
HETATM   42  H   UNL     1       2.244  -1.514   1.561  1.00  0.00           H  
HETATM   43  H   UNL     1       3.570  -3.018  -0.605  1.00  0.00           H  
HETATM   44  H   UNL     1       4.040  -4.772   0.841  1.00  0.00           H  
HETATM   45  H   UNL     1       3.601  -3.761   2.251  1.00  0.00           H  
HETATM   46  H   UNL     1       1.806  -5.198   0.292  1.00  0.00           H  
HETATM   47  H   UNL     1       1.893  -5.731   2.635  1.00  0.00           H  
HETATM   48  H   UNL     1       0.380  -2.928   1.436  1.00  0.00           H  
HETATM   49  H   UNL     1       0.656  -3.293  -0.294  1.00  0.00           H  
HETATM   50  H   UNL     1       3.986  -1.061  -2.246  1.00  0.00           H  
HETATM   51  H   UNL     1       5.786   0.605  -2.410  1.00  0.00           H  
HETATM   52  H   UNL     1       2.221   1.128   0.963  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    3    1    1   16                                       
CONECT    3    4    4    9    2                                       
CONECT    4    7    5    3    3                                       
CONECT    5    6    4                                                 
CONECT    6    5   33   34   35                                       
CONECT    7    8    8    4   36                                       
CONECT    8   14    7    7   10                                       
CONECT    9   10   10    3   37                                       
CONECT   10    8   11    9    9                                       
CONECT   11   12   12   10   38                                       
CONECT   12   13   11   11   39                                       
CONECT   13   14   14   12                                            
CONECT   14   15   13   13    8                                       
CONECT   15   14                                                      
CONECT   16    2   17   40                                            
CONECT   17   24   16   18   41                                       
CONECT   18   17   23   19   42                                       
CONECT   19   18   20   43                                            
CONECT   20   19   21   44   45                                       
CONECT   21   23   20   22   46                                       
CONECT   22   21   47                                                 
CONECT   23   18   21   48   49                                       
CONECT   24   32   32   25   17                                       
CONECT   25   26   26   24   50                                       
CONECT   26   27   25   25   51                                       
CONECT   27   28   30   30   26                                       
CONECT   28   29   29   29   27                                       
CONECT   29   28   28   28                                            
CONECT   30   31   27   27   32                                       
CONECT   31   30                                                      
CONECT   32   30   24   24   52                                       
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   12                                                      
CONECT   40   16                                                      
CONECT   41   17                                                      
CONECT   42   18                                                      
CONECT   43   19                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   23                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   32                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
