COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       2.969   1.584  -0.242  1.00  0.00           C  
HETATM    2  C   UNL     1      -1.800   1.175   0.989  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.847  -0.216  -0.581  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.118  -0.608  -0.993  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.219  -0.052  -0.350  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.783   1.501   1.003  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.217   2.009  -0.152  1.00  0.00           C  
HETATM    8  C   UNL     1      -6.130   1.378  -0.726  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.606   0.232  -0.143  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.263   0.360   1.587  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.120  -2.717  -1.245  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.714  -1.458  -1.724  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.180  -0.279   1.015  1.00  0.00           C  
HETATM   14  C   UNL     1       1.551  -0.249  -0.857  1.00  0.00           C  
HETATM   15  N   UNL     1      -3.019   0.830   0.629  1.00  0.00           N  
HETATM   16  N   UNL     1      -0.732   0.667   0.409  1.00  0.00           N  
HETATM   17  N   UNL     1      -4.507  -0.409  -0.723  1.00  0.00           N  
HETATM   18  N   UNL     1      -3.662  -3.689  -0.876  1.00  0.00           N  
HETATM   19  N   UNL     1       0.283  -0.741  -1.190  1.00  0.00           N  
HETATM   20  C   UNL     1       1.719   1.099  -0.569  1.00  0.00           C  
HETATM   21  C   UNL     1       4.058   0.725  -0.200  1.00  0.00           C  
HETATM   22  C   UNL     1       3.892  -0.621  -0.492  1.00  0.00           C  
HETATM   23  C   UNL     1       2.641  -1.108  -0.815  1.00  0.00           C  
HETATM   24  O   UNL     1       5.289   1.203   0.123  1.00  0.00           O  
HETATM   25  C   UNL     1       6.188   0.093   0.081  1.00  0.00           C  
HETATM   26  C   UNL     1       7.599   0.565   0.436  1.00  0.00           C  
HETATM   27  C   UNL     1       8.536  -0.642   0.513  1.00  0.00           C  
HETATM   28  N   UNL     1       9.862  -0.204   0.971  1.00  0.00           N  
HETATM   29  C   UNL     1      10.633  -1.421   1.256  1.00  0.00           C  
HETATM   30  C   UNL     1      10.509   0.448  -0.176  1.00  0.00           C  
HETATM   31  O   UNL     1       8.066   1.467  -0.569  1.00  0.00           O  
HETATM   32 CL   UNL     1      -5.529  -1.712   1.748  1.00  0.00          Cl  
HETATM   33  C   UNL     1      -7.786   3.252  -0.785  1.00  0.00           C  
HETATM   34  H   UNL     1       3.100   2.632  -0.017  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.673   1.893   1.786  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.246  -1.325  -1.790  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.632   1.996   1.450  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.689   1.776  -1.628  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.707  -0.034   2.490  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.783  -1.600  -1.886  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.241  -1.166  -2.661  1.00  0.00           H  
HETATM   42  H   UNL     1       0.195  -1.450  -1.847  1.00  0.00           H  
HETATM   43  H   UNL     1       0.871   1.768  -0.602  1.00  0.00           H  
HETATM   44  H   UNL     1       4.740  -1.289  -0.460  1.00  0.00           H  
HETATM   45  H   UNL     1       2.511  -2.157  -1.039  1.00  0.00           H  
HETATM   46  H   UNL     1       6.189  -0.336  -0.921  1.00  0.00           H  
HETATM   47  H   UNL     1       5.866  -0.662   0.798  1.00  0.00           H  
HETATM   48  H   UNL     1       7.580   1.073   1.400  1.00  0.00           H  
HETATM   49  H   UNL     1       8.624  -1.098  -0.473  1.00  0.00           H  
HETATM   50  H   UNL     1       8.132  -1.371   1.216  1.00  0.00           H  
HETATM   51  H   UNL     1      11.630  -1.147   1.600  1.00  0.00           H  
HETATM   52  H   UNL     1      10.128  -1.999   2.029  1.00  0.00           H  
HETATM   53  H   UNL     1      10.714  -2.021   0.349  1.00  0.00           H  
HETATM   54  H   UNL     1       9.970   1.361  -0.427  1.00  0.00           H  
HETATM   55  H   UNL     1      11.540   0.693   0.081  1.00  0.00           H  
HETATM   56  H   UNL     1      10.499  -0.228  -1.031  1.00  0.00           H  
HETATM   57  H   UNL     1       8.067   0.979  -1.404  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.558   2.974  -1.502  1.00  0.00           H  
HETATM   59  H   UNL     1      -8.220   3.887  -0.012  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.992   3.795  -1.297  1.00  0.00           H  
CONECT    1   20   20   21   34                                       
CONECT    2   15   15   16   35                                       
CONECT    3    4   16   16   19                                       
CONECT    4    3    5    5   36                                       
CONECT    5    4    4   15   17                                       
CONECT    6    7    7   10   37                                       
CONECT    7    6    6    8   33                                       
CONECT    8    7    9    9   38                                       
CONECT    9    8    8   13   17                                       
CONECT   10    6   13   13   39                                       
CONECT   11   12   18   18   18                                       
CONECT   12   11   17   40   41                                       
CONECT   13    9   10   10   32                                       
CONECT   14   19   20   23   23                                       
CONECT   15    2    2    5                                            
CONECT   16    2    3    3                                            
CONECT   17    5    9   12                                            
CONECT   18   11   11   11                                            
CONECT   19    3   14   42                                            
CONECT   20    1    1   14   43                                       
CONECT   21    1   22   22   24                                       
CONECT   22   21   21   23   44                                       
CONECT   23   14   14   22   45                                       
CONECT   24   21   25                                                 
CONECT   25   24   26   46   47                                       
CONECT   26   25   27   31   48                                       
CONECT   27   26   28   49   50                                       
CONECT   28   27   29   30                                            
CONECT   29   28   51   52   53                                       
CONECT   30   28   54   55   56                                       
CONECT   31   26   57                                                 
CONECT   32   13                                                      
CONECT   33    7   58   59   60                                       
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38    8                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   19                                                      
CONECT   43   20                                                      
CONECT   44   22                                                      
CONECT   45   23                                                      
CONECT   46   25                                                      
CONECT   47   25                                                      
CONECT   48   26                                                      
CONECT   49   27                                                      
CONECT   50   27                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
CONECT   53   29                                                      
CONECT   54   30                                                      
CONECT   55   30                                                      
CONECT   56   30                                                      
CONECT   57   31                                                      
CONECT   58   33                                                      
CONECT   59   33                                                      
CONECT   60   33                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
