COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -7.486   0.729  -0.644  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.529  -0.007   0.283  1.00  0.00           C  
HETATM    3  C   UNL     1      -7.900  -0.603  -0.012  1.00  0.00           C  
HETATM    4  C   UNL     1      -7.166   0.732  -2.117  1.00  0.00           C  
HETATM    5  O   UNL     1      -6.178   0.166  -2.521  1.00  0.00           O  
HETATM    6  O   UNL     1      -7.978   1.363  -2.979  1.00  0.00           O  
HETATM    7  C   UNL     1      -6.164   0.526   1.643  1.00  0.00           C  
HETATM    8  N   UNL     1      -5.007  -0.028   2.053  1.00  0.00           N  
HETATM    9  O   UNL     1      -6.814   1.332   2.274  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.488  -0.979   1.062  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.240  -0.659  -0.251  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.006  -0.781   0.875  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.474   0.495   0.883  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.115   0.679   0.712  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.285  -0.418   0.532  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.822  -1.697   0.524  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.180  -1.876   0.701  1.00  0.00           C  
HETATM   18  O   UNL     1       1.051  -0.240   0.363  1.00  0.00           O  
HETATM   19  C   UNL     1       1.845  -1.415   0.183  1.00  0.00           C  
HETATM   20  C   UNL     1       3.290  -1.023   0.012  1.00  0.00           C  
HETATM   21  N   UNL     1       5.946  -0.296  -0.300  1.00  0.00           N  
HETATM   22  C   UNL     1       5.021   0.626  -0.113  1.00  0.00           C  
HETATM   23  C   UNL     1       3.669   0.285   0.048  1.00  0.00           C  
HETATM   24  C   UNL     1       5.634  -1.594  -0.339  1.00  0.00           C  
HETATM   25  C   UNL     1       4.286  -2.002  -0.183  1.00  0.00           C  
HETATM   26  C   UNL     1       3.966  -3.368  -0.226  1.00  0.00           C  
HETATM   27  C   UNL     1       4.954  -4.286  -0.416  1.00  0.00           C  
HETATM   28  C   UNL     1       6.280  -3.887  -0.570  1.00  0.00           C  
HETATM   29  C   UNL     1       6.626  -2.571  -0.534  1.00  0.00           C  
HETATM   30  C   UNL     1       5.418   2.054  -0.077  1.00  0.00           C  
HETATM   31  C   UNL     1       6.755   2.413  -0.240  1.00  0.00           C  
HETATM   32  C   UNL     1       7.119   3.744  -0.206  1.00  0.00           C  
HETATM   33  C   UNL     1       6.159   4.721  -0.010  1.00  0.00           C  
HETATM   34  C   UNL     1       4.831   4.371   0.152  1.00  0.00           C  
HETATM   35  C   UNL     1       4.455   3.043   0.113  1.00  0.00           C  
HETATM   36  H   UNL     1      -7.958   1.635  -0.264  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.643  -0.573   0.784  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.940  -1.477  -0.661  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.732   1.337  -3.914  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.571   0.176   2.896  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.695  -2.001   1.376  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.464  -1.570  -0.805  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.674   0.041  -0.865  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.120   1.349   1.023  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.700   1.676   0.718  1.00  0.00           H  
HETATM   46  H   UNL     1      -0.178  -2.553   0.384  1.00  0.00           H  
HETATM   47  H   UNL     1      -2.598  -2.872   0.700  1.00  0.00           H  
HETATM   48  H   UNL     1       1.744  -2.059   1.056  1.00  0.00           H  
HETATM   49  H   UNL     1       1.506  -1.950  -0.705  1.00  0.00           H  
HETATM   50  H   UNL     1       2.930   1.059   0.199  1.00  0.00           H  
HETATM   51  H   UNL     1       2.941  -3.690  -0.108  1.00  0.00           H  
HETATM   52  H   UNL     1       4.706  -5.336  -0.448  1.00  0.00           H  
HETATM   53  H   UNL     1       7.045  -4.634  -0.720  1.00  0.00           H  
HETATM   54  H   UNL     1       7.659  -2.279  -0.655  1.00  0.00           H  
HETATM   55  H   UNL     1       7.505   1.651  -0.393  1.00  0.00           H  
HETATM   56  H   UNL     1       8.154   4.023  -0.332  1.00  0.00           H  
HETATM   57  H   UNL     1       6.448   5.761   0.017  1.00  0.00           H  
HETATM   58  H   UNL     1       4.086   5.138   0.305  1.00  0.00           H  
HETATM   59  H   UNL     1       3.417   2.771   0.240  1.00  0.00           H  
CONECT    1    3    2    4   36                                       
CONECT    2    1    3    7   11                                       
CONECT    3    1    2   37   38                                       
CONECT    4    1    5    5    6                                       
CONECT    5    4    4                                                 
CONECT    6    4   39                                                 
CONECT    7    2    9    9    8                                       
CONECT    8    7   10   40                                            
CONECT    9    7    7                                                 
CONECT   10    8   11   12   41                                       
CONECT   11    2   10   42   43                                       
CONECT   12   10   17   17   13                                       
CONECT   13   12   14   14   44                                       
CONECT   14   13   13   15   45                                       
CONECT   15   14   16   16   18                                       
CONECT   16   15   15   17   46                                       
CONECT   17   12   12   16   47                                       
CONECT   18   15   19                                                 
CONECT   19   18   20   48   49                                       
CONECT   20   19   23   23   25                                       
CONECT   21   22   22   24                                            
CONECT   22   21   21   23   30                                       
CONECT   23   20   20   22   50                                       
CONECT   24   21   25   25   29                                       
CONECT   25   20   24   24   26                                       
CONECT   26   25   27   27   51                                       
CONECT   27   26   26   28   52                                       
CONECT   28   27   29   29   53                                       
CONECT   29   24   28   28   54                                       
CONECT   30   22   35   35   31                                       
CONECT   31   30   32   32   55                                       
CONECT   32   31   31   33   56                                       
CONECT   33   32   34   34   57                                       
CONECT   34   33   33   35   58                                       
CONECT   35   30   30   34   59                                       
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   11                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   23                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   33                                                      
CONECT   58   34                                                      
CONECT   59   35                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
