COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       8.701   2.146  -1.555  1.00  0.00           C  
HETATM    2  N   UNL     1       7.604   1.379  -0.951  1.00  0.00           N  
HETATM    3  C   UNL     1       7.212   1.951   0.345  1.00  0.00           C  
HETATM    4  C   UNL     1       6.124   1.079   0.977  1.00  0.00           C  
HETATM    5  N   UNL     1       4.972   1.003   0.068  1.00  0.00           N  
HETATM    6  C   UNL     1       5.364   0.431  -1.228  1.00  0.00           C  
HETATM    7  C   UNL     1       6.451   1.303  -1.859  1.00  0.00           C  
HETATM    8  C   UNL     1       3.928   0.273   0.643  1.00  0.00           C  
HETATM    9  C   UNL     1       4.080  -0.264   1.921  1.00  0.00           C  
HETATM   10  C   UNL     1       3.074  -0.981   2.504  1.00  0.00           C  
HETATM   11  C   UNL     1       1.874  -1.183   1.818  1.00  0.00           C  
HETATM   12  N   UNL     1       0.853  -1.890   2.365  1.00  0.00           N  
HETATM   13  C   UNL     1      -0.262  -2.079   1.729  1.00  0.00           C  
HETATM   14  N   UNL     1      -0.502  -1.594   0.480  1.00  0.00           N  
HETATM   15  C   UNL     1      -1.735  -1.844  -0.137  1.00  0.00           C  
HETATM   16  C   UNL     1      -2.789  -0.958   0.034  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.008  -1.209  -0.579  1.00  0.00           C  
HETATM   18  N   UNL     1      -5.074  -0.319  -0.409  1.00  0.00           N  
HETATM   19  C   UNL     1      -4.834   1.001  -0.279  1.00  0.00           C  
HETATM   20  O   UNL     1      -3.703   1.430  -0.404  1.00  0.00           O  
HETATM   21  C   UNL     1      -5.943   1.926   0.016  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.863   3.383   0.189  1.00  0.00           C  
HETATM   23  C   UNL     1      -7.116   3.794   0.441  1.00  0.00           C  
HETATM   24  O   UNL     1      -7.936   2.732   0.436  1.00  0.00           O  
HETATM   25  C   UNL     1      -7.260   1.608   0.179  1.00  0.00           C  
HETATM   26  C   UNL     1      -4.170  -2.346  -1.361  1.00  0.00           C  
HETATM   27  C   UNL     1      -3.118  -3.225  -1.529  1.00  0.00           C  
HETATM   28  C   UNL     1      -1.901  -2.975  -0.925  1.00  0.00           C  
HETATM   29  C   UNL     1      -0.754  -3.934  -1.117  1.00  0.00           C  
HETATM   30  C   UNL     1       0.440  -0.872  -0.171  1.00  0.00           C  
HETATM   31  C   UNL     1       1.715  -0.641   0.523  1.00  0.00           C  
HETATM   32  C   UNL     1       2.747   0.093  -0.057  1.00  0.00           C  
HETATM   33  O   UNL     1       0.239  -0.431  -1.288  1.00  0.00           O  
HETATM   34  H   UNL     1       9.565   2.130  -0.890  1.00  0.00           H  
HETATM   35  H   UNL     1       8.971   1.701  -2.512  1.00  0.00           H  
HETATM   36  H   UNL     1       8.381   3.177  -1.710  1.00  0.00           H  
HETATM   37  H   UNL     1       8.079   1.985   1.005  1.00  0.00           H  
HETATM   38  H   UNL     1       6.828   2.960   0.196  1.00  0.00           H  
HETATM   39  H   UNL     1       6.059   2.305  -2.034  1.00  0.00           H  
HETATM   40  H   UNL     1       6.764   0.864  -2.807  1.00  0.00           H  
HETATM   41  H   UNL     1       6.517   0.078   1.151  1.00  0.00           H  
HETATM   42  H   UNL     1       5.812   1.518   1.924  1.00  0.00           H  
HETATM   43  H   UNL     1       5.747  -0.578  -1.078  1.00  0.00           H  
HETATM   44  H   UNL     1       4.497   0.397  -1.887  1.00  0.00           H  
HETATM   45  H   UNL     1       5.005  -0.112   2.457  1.00  0.00           H  
HETATM   46  H   UNL     1       3.206  -1.391   3.494  1.00  0.00           H  
HETATM   47  H   UNL     1      -1.039  -2.649   2.216  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.661  -0.075   0.643  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.984  -0.651  -0.386  1.00  0.00           H  
HETATM   50  H   UNL     1      -5.119  -2.542  -1.838  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.977   3.998   0.127  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.684   0.617   0.114  1.00  0.00           H  
HETATM   53  H   UNL     1      -7.415   4.816   0.619  1.00  0.00           H  
HETATM   54  H   UNL     1      -3.246  -4.108  -2.138  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.783  -4.695  -0.337  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.838  -4.410  -2.093  1.00  0.00           H  
HETATM   57  H   UNL     1       0.189  -3.389  -1.058  1.00  0.00           H  
HETATM   58  H   UNL     1       2.629   0.513  -1.045  1.00  0.00           H  
CONECT    1    2   34   35   36                                       
CONECT    2    1    3    7                                            
CONECT    3    2    4   37   38                                       
CONECT    4    3    5   41   42                                       
CONECT    5    4    6    8                                            
CONECT    6    5    7   43   44                                       
CONECT    7    2    6   39   40                                       
CONECT    8    5    9   32   32                                       
CONECT    9    8   10   10   45                                       
CONECT   10    9    9   11   46                                       
CONECT   11   10   12   31   31                                       
CONECT   12   11   13   13                                            
CONECT   13   12   12   14   47                                       
CONECT   14   13   15   30                                            
CONECT   15   14   16   28   28                                       
CONECT   16   15   17   17   48                                       
CONECT   17   16   16   18   26                                       
CONECT   18   17   19   49                                            
CONECT   19   18   20   20   21                                       
CONECT   20   19   19                                                 
CONECT   21   19   22   25   25                                       
CONECT   22   21   23   23   51                                       
CONECT   23   22   22   24   53                                       
CONECT   24   23   25                                                 
CONECT   25   21   21   24   52                                       
CONECT   26   17   27   27   50                                       
CONECT   27   26   26   28   54                                       
CONECT   28   15   15   27   29                                       
CONECT   29   28   55   56   57                                       
CONECT   30   14   33   33   31                                       
CONECT   31   11   11   30   32                                       
CONECT   32    8    8   31   58                                       
CONECT   33   30   30                                                 
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    6                                                      
CONECT   44    6                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   13                                                      
CONECT   48   16                                                      
CONECT   49   18                                                      
CONECT   50   26                                                      
CONECT   51   22                                                      
CONECT   52   25                                                      
CONECT   53   23                                                      
CONECT   54   27                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   29                                                      
CONECT   58   32                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
