COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       5.751  -0.473  -2.197  1.00  0.00           O  
HETATM    2  C   UNL     1       4.468   0.590   0.996  1.00  0.00           C  
HETATM    3  O   UNL     1       5.017   0.818   2.057  1.00  0.00           O  
HETATM    4  C   UNL     1       8.459  -2.385   1.179  1.00  0.00           C  
HETATM    5  C   UNL     1       7.573  -1.992   2.169  1.00  0.00           C  
HETATM    6  C   UNL     1       6.410  -1.324   1.842  1.00  0.00           C  
HETATM    7  C   UNL     1       6.121  -1.042   0.513  1.00  0.00           C  
HETATM    8  C   UNL     1       7.016  -1.439  -0.492  1.00  0.00           C  
HETATM    9  C   UNL     1       8.189  -2.114  -0.144  1.00  0.00           C  
HETATM   10  O   UNL     1      -0.048   3.545  -0.513  1.00  0.00           O  
HETATM   11  C   UNL     1       3.279   1.368   0.598  1.00  0.00           C  
HETATM   12  O   UNL     1      -6.072   1.707  -0.355  1.00  0.00           O  
HETATM   13  C   UNL     1       2.646   1.108  -0.620  1.00  0.00           C  
HETATM   14  N   UNL     1       4.949  -0.369   0.181  1.00  0.00           N  
HETATM   15  C   UNL     1       6.720  -1.146  -1.906  1.00  0.00           C  
HETATM   16  O   UNL     1       7.524  -1.625  -2.876  1.00  0.00           O  
HETATM   17  C   UNL     1       1.536   1.836  -0.987  1.00  0.00           C  
HETATM   18  C   UNL     1       1.046   2.829  -0.148  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.262   2.947  -0.417  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.416   3.672  -0.691  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.650   3.069  -0.594  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.741   1.725  -0.220  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.062   1.074  -0.115  1.00  0.00           C  
HETATM   24  C   UNL     1      -6.387  -0.854   0.277  1.00  0.00           C  
HETATM   25  C   UNL     1      -7.542  -0.116   0.500  1.00  0.00           C  
HETATM   26  C   UNL     1      -8.771  -0.744   0.526  1.00  0.00           C  
HETATM   27  C   UNL     1      -8.862  -2.113   0.330  1.00  0.00           C  
HETATM   28  C   UNL     1      -7.728  -2.862   0.108  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.477  -2.240   0.078  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.259  -3.035  -0.159  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.579   0.999   0.055  1.00  0.00           C  
HETATM   32  C   UNL     1      -1.349   1.608  -0.049  1.00  0.00           C  
HETATM   33  C   UNL     1       1.672   3.092   1.065  1.00  0.00           C  
HETATM   34  C   UNL     1       2.779   2.364   1.442  1.00  0.00           C  
HETATM   35  N   UNL     1      -5.148  -0.221   0.246  1.00  0.00           N  
HETATM   36  O   UNL     1      -4.166  -2.507  -0.094  1.00  0.00           O  
HETATM   37  O   UNL     1      -5.356  -4.348  -0.447  1.00  0.00           O  
HETATM   38  H   UNL     1       9.368  -2.903   1.447  1.00  0.00           H  
HETATM   39  H   UNL     1       7.793  -2.209   3.204  1.00  0.00           H  
HETATM   40  H   UNL     1       5.725  -1.021   2.620  1.00  0.00           H  
HETATM   41  H   UNL     1       8.885  -2.419  -0.912  1.00  0.00           H  
HETATM   42  H   UNL     1       3.027   0.337  -1.273  1.00  0.00           H  
HETATM   43  H   UNL     1       4.478  -0.591  -0.638  1.00  0.00           H  
HETATM   44  H   UNL     1       7.289  -1.407  -3.788  1.00  0.00           H  
HETATM   45  H   UNL     1       1.047   1.635  -1.929  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.345   4.710  -0.980  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.546   3.633  -0.807  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.479   0.952   0.654  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.666  -0.166   0.700  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.828  -2.595   0.352  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.805  -3.929  -0.043  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.646  -0.039   0.345  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.450   1.047   0.158  1.00  0.00           H  
HETATM   54  H   UNL     1       1.288   3.864   1.714  1.00  0.00           H  
HETATM   55  H   UNL     1       3.262   2.565   2.387  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.346  -0.713   0.484  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.530  -4.828  -0.594  1.00  0.00           H  
CONECT    1   15   15                                                 
CONECT    2    3    3   11   14                                       
CONECT    3    2    2                                                 
CONECT    4    5    9    9   38                                       
CONECT    5    6    6    4   39                                       
CONECT    6    5    5    7   40                                       
CONECT    7    6   14    8    8                                       
CONECT    8    7    7    9   15                                       
CONECT    9    4    4    8   41                                       
CONECT   10   18   19                                                 
CONECT   11   13    2   34   34                                       
CONECT   12   23   23                                                 
CONECT   13   17   17   11   42                                       
CONECT   14    2    7   43                                            
CONECT   15    8    1    1   16                                       
CONECT   16   15   44                                                 
CONECT   17   13   13   18   45                                       
CONECT   18   17   10   33   33                                       
CONECT   19   10   32   32   20                                       
CONECT   20   19   21   21   46                                       
CONECT   21   20   20   22   47                                       
CONECT   22   31   31   21   23                                       
CONECT   23   22   35   12   12                                       
CONECT   24   35   29   29   25                                       
CONECT   25   24   26   26   48                                       
CONECT   26   25   25   27   49                                       
CONECT   27   28   28   26   50                                       
CONECT   28   29   27   27   51                                       
CONECT   29   30   24   24   28                                       
CONECT   30   36   36   37   29                                       
CONECT   31   32   22   22   52                                       
CONECT   32   19   19   31   53                                       
CONECT   33   18   18   34   54                                       
CONECT   34   11   11   33   55                                       
CONECT   35   23   24   56                                            
CONECT   36   30   30                                                 
CONECT   37   30   57                                                 
CONECT   38    4                                                      
CONECT   39    5                                                      
CONECT   40    6                                                      
CONECT   41    9                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   31                                                      
CONECT   53   32                                                      
CONECT   54   33                                                      
CONECT   55   34                                                      
CONECT   56   35                                                      
CONECT   57   37                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
