COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       6.307  -0.214  -0.590  1.00  0.00           C  
HETATM    2  C   UNL     1       5.818  -1.282  -1.573  1.00  0.00           C  
HETATM    3  C   UNL     1       4.857  -2.515   0.373  1.00  0.00           C  
HETATM    4  C   UNL     1       4.845  -3.845   1.129  1.00  0.00           C  
HETATM    5  O   UNL     1       4.060   0.174   0.214  1.00  0.00           O  
HETATM    6  O   UNL     1       6.294   1.065  -1.228  1.00  0.00           O  
HETATM    7  O   UNL     1      -7.048  -3.597   1.647  1.00  0.00           O  
HETATM    8  C   UNL     1      -6.497  -2.740   0.980  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.297  -2.933  -0.408  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.764  -4.200  -1.078  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.683  -1.967  -1.124  1.00  0.00           C  
HETATM   12  N   UNL     1      -6.075  -1.596   1.556  1.00  0.00           N  
HETATM   13  C   UNL     1      -5.471  -0.647   0.818  1.00  0.00           C  
HETATM   14  O   UNL     1      -5.092   0.377   1.352  1.00  0.00           O  
HETATM   15  N   UNL     1      -5.266  -0.823  -0.500  1.00  0.00           N  
HETATM   16  C   UNL     1      -4.605   0.228  -1.278  1.00  0.00           C  
HETATM   17  O   UNL     1      -3.345   0.586  -0.671  1.00  0.00           O  
HETATM   18  C   UNL     1      -5.441   1.527  -1.247  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.385   2.652  -1.183  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.486   3.500  -2.329  1.00  0.00           O  
HETATM   21  C   UNL     1      -3.035   1.901  -1.183  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.032   2.606  -0.268  1.00  0.00           C  
HETATM   23  O   UNL     1      -0.779   1.920  -0.316  1.00  0.00           O  
HETATM   24  P   UNL     1       0.510   2.389   0.527  1.00  0.00           P  
HETATM   25  O   UNL     1       0.999   3.831   0.003  1.00  0.00           O  
HETATM   26  O   UNL     1       0.155   2.480   1.961  1.00  0.00           O  
HETATM   27  O   UNL     1       1.696   1.317   0.335  1.00  0.00           O  
HETATM   28  P   UNL     1       3.028   0.963   1.166  1.00  0.00           P  
HETATM   29  O   UNL     1       2.645   0.037   2.426  1.00  0.00           O  
HETATM   30  O   UNL     1       3.658   2.214   1.645  1.00  0.00           O  
HETATM   31  C   UNL     1       5.379  -0.189   0.628  1.00  0.00           C  
HETATM   32  O   UNL     1       6.720  -1.363  -2.678  1.00  0.00           O  
HETATM   33  C   UNL     1       5.764  -2.634  -0.855  1.00  0.00           C  
HETATM   34  O   UNL     1       5.240  -3.625  -1.742  1.00  0.00           O  
HETATM   35  O   UNL     1       5.350  -1.484   1.230  1.00  0.00           O  
HETATM   36  H   UNL     1       7.321  -0.451  -0.269  1.00  0.00           H  
HETATM   37  H   UNL     1       4.823  -1.018  -1.932  1.00  0.00           H  
HETATM   38  H   UNL     1       3.844  -2.270   0.054  1.00  0.00           H  
HETATM   39  H   UNL     1       5.858  -4.091   1.448  1.00  0.00           H  
HETATM   40  H   UNL     1       4.199  -3.761   2.003  1.00  0.00           H  
HETATM   41  H   UNL     1       4.469  -4.632   0.474  1.00  0.00           H  
HETATM   42  H   UNL     1       6.592   1.790  -0.662  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.231  -4.850  -0.339  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.487  -3.954  -1.855  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.910  -4.711  -1.524  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.522  -2.097  -2.184  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.209  -1.457   2.507  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.451  -0.101  -2.306  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.041   1.617  -2.153  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.078   1.550  -0.363  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.499   3.232  -0.267  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.338   3.951  -2.411  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.641   1.829  -2.197  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.896   3.635  -0.603  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.409   2.604   0.754  1.00  0.00           H  
HETATM   56  H   UNL     1       1.248   3.846  -0.932  1.00  0.00           H  
HETATM   57  H   UNL     1       2.227  -0.801   2.185  1.00  0.00           H  
HETATM   58  H   UNL     1       5.746   0.540   1.350  1.00  0.00           H  
HETATM   59  H   UNL     1       6.809  -0.538  -3.175  1.00  0.00           H  
HETATM   60  H   UNL     1       6.767  -2.920  -0.540  1.00  0.00           H  
HETATM   61  H   UNL     1       5.177  -4.508  -1.352  1.00  0.00           H  
CONECT    1    6   31    2   36                                       
CONECT    2    1   32   33   37                                       
CONECT    3   35   33    4   38                                       
CONECT    4    3   39   40   41                                       
CONECT    5   28   31                                                 
CONECT    6    1   42                                                 
CONECT    7    8    8                                                 
CONECT    8   12    9    7    7                                       
CONECT    9   11   11    8   10                                       
CONECT   10    9   43   44   45                                       
CONECT   11   15    9    9   46                                       
CONECT   12   13    8   47                                            
CONECT   13   14   14   15   12                                       
CONECT   14   13   13                                                 
CONECT   15   16   13   11                                            
CONECT   16   18   17   15   48                                       
CONECT   17   16   21                                                 
CONECT   18   16   19   49   50                                       
CONECT   19   20   18   21   51                                       
CONECT   20   19   52                                                 
CONECT   21   19   17   22   53                                       
CONECT   22   21   23   54   55                                       
CONECT   23   22   24                                                 
CONECT   24   23   26   26   25                                       
CONECT   24   27                                                      
CONECT   25   24   56                                                 
CONECT   26   24   24                                                 
CONECT   27   24   28                                                 
CONECT   28   27   30   30   29                                       
CONECT   28    5                                                      
CONECT   29   28   57                                                 
CONECT   30   28   28                                                 
CONECT   31    5    1   35   58                                       
CONECT   32    2   59                                                 
CONECT   33    2    3   34   60                                       
CONECT   34   33   61                                                 
CONECT   35   31    3                                                 
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    4                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    6                                                      
CONECT   43   10                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   16                                                      
CONECT   49   18                                                      
CONECT   50   18                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   21                                                      
CONECT   54   22                                                      
CONECT   55   22                                                      
CONECT   56   25                                                      
CONECT   57   29                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
