COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.300  -8.062  -1.370  1.00  0.00           C  
HETATM    2  O   UNL     1      -3.302  -7.060  -1.184  1.00  0.00           O  
HETATM    3  C   UNL     1      -2.823  -5.868  -0.557  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.975  -4.872  -0.410  1.00  0.00           C  
HETATM    5  N   UNL     1      -3.484  -3.650   0.234  1.00  0.00           N  
HETATM    6  C   UNL     1      -3.598  -2.399  -0.256  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.822  -3.581   1.465  1.00  0.00           N  
HETATM    8  C   UNL     1      -2.537  -2.331   1.715  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.015  -1.550   0.643  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.909  -0.080   0.516  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.032   0.690   0.522  1.00  0.00           C  
HETATM   12  N   UNL     1      -3.959   2.017   0.409  1.00  0.00           N  
HETATM   13  C   UNL     1      -2.800   2.634   0.287  1.00  0.00           C  
HETATM   14  N   UNL     1      -2.756   4.015   0.171  1.00  0.00           N  
HETATM   15  C   UNL     1      -3.975   4.827   0.317  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.071   5.775  -0.884  1.00  0.00           C  
HETATM   17  O   UNL     1      -2.842   6.494  -1.015  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.706   5.667  -1.281  1.00  0.00           C  
HETATM   19  C   UNL     1      -1.488   4.713  -0.095  1.00  0.00           C  
HETATM   20  C   UNL     1      -1.600   1.881   0.275  1.00  0.00           C  
HETATM   21  N   UNL     1      -0.325   2.214   0.169  1.00  0.00           N  
HETATM   22  N   UNL     1      -1.673   0.517   0.397  1.00  0.00           N  
HETATM   23  C   UNL     1      -0.398   0.041   0.363  1.00  0.00           C  
HETATM   24  C   UNL     1       0.421   1.109   0.214  1.00  0.00           C  
HETATM   25  C   UNL     1       1.925   1.058   0.126  1.00  0.00           C  
HETATM   26  O   UNL     1       2.362  -0.299   0.225  1.00  0.00           O  
HETATM   27  C   UNL     1       3.698  -0.521   0.163  1.00  0.00           C  
HETATM   28  C   UNL     1       4.177  -1.833   0.250  1.00  0.00           C  
HETATM   29  C   UNL     1       5.518  -2.073   0.184  1.00  0.00           C  
HETATM   30  C   UNL     1       6.385  -0.974   0.028  1.00  0.00           C  
HETATM   31  C   UNL     1       7.776  -1.148  -0.048  1.00  0.00           C  
HETATM   32  C   UNL     1       8.583  -0.061  -0.199  1.00  0.00           C  
HETATM   33  C   UNL     1       8.047   1.222  -0.278  1.00  0.00           C  
HETATM   34  C   UNL     1       6.703   1.427  -0.208  1.00  0.00           C  
HETATM   35  C   UNL     1       5.838   0.330  -0.053  1.00  0.00           C  
HETATM   36  N   UNL     1       4.513   0.502   0.018  1.00  0.00           N  
HETATM   37  H   UNL     1      -1.891  -8.350  -0.401  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.742  -8.933  -1.852  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.502  -7.666  -1.997  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.425  -6.111   0.429  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.036  -5.427  -1.168  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.372  -4.628  -1.395  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.762  -5.313   0.201  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.065  -2.118  -1.189  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.026  -1.961   2.592  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.998   0.219   0.621  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.849   4.176   0.341  1.00  0.00           H  
HETATM   48  H   UNL     1      -3.922   5.406   1.239  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.254   5.198  -1.790  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.889   6.479  -0.727  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.881   5.089  -2.189  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.823   6.292  -1.412  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.189   5.281   0.786  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.715   3.987  -0.344  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.097  -0.994   0.433  1.00  0.00           H  
HETATM   56  H   UNL     1       2.247   1.475  -0.828  1.00  0.00           H  
HETATM   57  H   UNL     1       2.356   1.640   0.941  1.00  0.00           H  
HETATM   58  H   UNL     1       3.486  -2.654   0.369  1.00  0.00           H  
HETATM   59  H   UNL     1       5.905  -3.079   0.249  1.00  0.00           H  
HETATM   60  H   UNL     1       8.204  -2.137   0.014  1.00  0.00           H  
HETATM   61  H   UNL     1       9.653  -0.196  -0.257  1.00  0.00           H  
HETATM   62  H   UNL     1       8.708   2.068  -0.397  1.00  0.00           H  
HETATM   63  H   UNL     1       6.303   2.428  -0.271  1.00  0.00           H  
CONECT    1    2   37   38   39                                       
CONECT    2    1    3                                                 
CONECT    3    2    4   40   41                                       
CONECT    4    3    5   42   43                                       
CONECT    5    7    4    6                                            
CONECT    6    5    9    9   44                                       
CONECT    7    5    8    8                                            
CONECT    8    7    7    9   45                                       
CONECT    9    8    6    6   10                                       
CONECT   10    9   22   11   11                                       
CONECT   11   10   10   12   46                                       
CONECT   12   11   13   13                                            
CONECT   13   20   12   12   14                                       
CONECT   14   13   15   19                                            
CONECT   15   14   16   47   48                                       
CONECT   16   15   17   49   50                                       
CONECT   17   16   18                                                 
CONECT   18   19   17   51   52                                       
CONECT   19   14   18   53   54                                       
CONECT   20   22   21   21   13                                       
CONECT   21   24   20   20                                            
CONECT   22   23   10   20                                            
CONECT   23   24   24   22   55                                       
CONECT   24   25   23   23   21                                       
CONECT   25   26   24   56   57                                       
CONECT   26   27   25                                                 
CONECT   27   28   28   36   26                                       
CONECT   28   29   27   27   58                                       
CONECT   29   30   30   28   59                                       
CONECT   30   31   29   29   35                                       
CONECT   31   32   32   30   60                                       
CONECT   32   31   31   33   61                                       
CONECT   33   32   34   34   62                                       
CONECT   34   33   33   35   63                                       
CONECT   35   30   34   36   36                                       
CONECT   36   35   35   27                                            
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    3                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    4                                                      
CONECT   44    6                                                      
CONECT   45    8                                                      
CONECT   46   11                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   18                                                      
CONECT   52   18                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   25                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   31                                                      
CONECT   61   32                                                      
CONECT   62   33                                                      
CONECT   63   34                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
