COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.027   5.176  -0.882  1.00  0.00           C  
HETATM    2  C   UNL     1       4.457   3.759  -0.974  1.00  0.00           C  
HETATM    3  C   UNL     1       4.137   3.246   0.432  1.00  0.00           C  
HETATM    4  N   UNL     1       3.592   1.889   0.344  1.00  0.00           N  
HETATM    5  C   UNL     1       2.272   1.588   0.308  1.00  0.00           C  
HETATM    6  C   UNL     1       4.348   0.742   0.281  1.00  0.00           C  
HETATM    7  C   UNL     1       5.720   0.500   0.278  1.00  0.00           C  
HETATM    8  C   UNL     1       6.156  -0.809   0.202  1.00  0.00           C  
HETATM    9  CA  UNL     1       5.219  -1.845   0.130  1.00  0.00           C  
HETATM   10  C   UNL     1       5.684  -3.241   0.050  1.00  0.00           C  
HETATM   11  O   UNL     1       4.880  -4.146  -0.013  1.00  0.00           O  
HETATM   12  N   UNL     1       3.916  -1.589   0.134  1.00  0.00           N  
HETATM   13  C   UNL     1       3.459  -0.351   0.206  1.00  0.00           C  
HETATM   14  C   UNL     1       2.106   0.236   0.220  1.00  0.00           C  
HETATM   15  C   UNL     1       0.831  -0.491   0.157  1.00  0.00           C  
HETATM   16  O   UNL     1       0.827  -1.705   0.080  1.00  0.00           O  
HETATM   17  N   UNL     1      -0.333   0.187   0.185  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.536  -0.491   0.019  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.720   0.229  -0.056  1.00  0.00           C  
HETATM   20  N   UNL     1      -1.532  -1.815  -0.069  1.00  0.00           N  
HETATM   21  C   UNL     1      -2.641  -2.506  -0.227  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.877  -1.863  -0.308  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.081  -2.618  -0.479  1.00  0.00           C  
HETATM   24  N   UNL     1      -6.037  -3.218  -0.614  1.00  0.00           N  
HETATM   25  C   UNL     1      -3.919  -0.455  -0.222  1.00  0.00           C  
HETATM   26  N   UNL     1      -5.123   0.228  -0.297  1.00  0.00           N  
HETATM   27  C   UNL     1      -5.144   1.689  -0.206  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.587   2.187  -0.317  1.00  0.00           C  
HETATM   29  O   UNL     1      -7.337   1.727   0.809  1.00  0.00           O  
HETATM   30  C   UNL     1      -8.705   2.139   0.803  1.00  0.00           C  
HETATM   31  H   UNL     1       5.255   5.541  -1.883  1.00  0.00           H  
HETATM   32  H   UNL     1       4.294   5.832  -0.413  1.00  0.00           H  
HETATM   33  H   UNL     1       5.938   5.163  -0.284  1.00  0.00           H  
HETATM   34  H   UNL     1       3.546   3.771  -1.572  1.00  0.00           H  
HETATM   35  H   UNL     1       5.190   3.102  -1.442  1.00  0.00           H  
HETATM   36  H   UNL     1       5.048   3.233   1.030  1.00  0.00           H  
HETATM   37  H   UNL     1       3.404   3.902   0.900  1.00  0.00           H  
HETATM   38  H   UNL     1       1.469   2.310   0.343  1.00  0.00           H  
HETATM   39  H   UNL     1       6.425   1.316   0.334  1.00  0.00           H  
HETATM   40  H   UNL     1       7.213  -1.030   0.198  1.00  0.00           H  
HETATM   41  H   UNL     1       6.742  -3.459   0.046  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.332   1.147   0.320  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.710   1.307   0.014  1.00  0.00           H  
HETATM   44  H   UNL     1      -2.594  -3.583  -0.294  1.00  0.00           H  
HETATM   45  H   UNL     1      -5.953  -0.263  -0.410  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.725   2.000   0.751  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.551   2.112  -1.017  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.595   3.277  -0.338  1.00  0.00           H  
HETATM   49  H   UNL     1      -7.035   1.802  -1.233  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.757   3.228   0.805  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.197   1.754  -0.090  1.00  0.00           H  
HETATM   52  H   UNL     1      -9.205   1.750   1.690  1.00  0.00           H  
CONECT    1    2   31   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    4    2   36   37                                       
CONECT    4    5    6    3                                            
CONECT    5   14   14    4   38                                       
CONECT    6   13    4    7    7                                       
CONECT    7    6    6    8   39                                       
CONECT    8    9    9    7   40                                       
CONECT    9   12   10    8    8                                       
CONECT   10    9   11   11   41                                       
CONECT   11   10   10                                                 
CONECT   12   13   13    9                                            
CONECT   13   14   12   12    6                                       
CONECT   14   15    5    5   13                                       
CONECT   15   16   16   17   14                                       
CONECT   16   15   15                                                 
CONECT   17   18   15   42                                            
CONECT   18   19   19   20   17                                       
CONECT   19   25   18   18   43                                       
CONECT   20   21   21   18                                            
CONECT   21   22   20   20   44                                       
CONECT   22   23   25   25   21                                       
CONECT   23   24   24   24   22                                       
CONECT   24   23   23   23                                            
CONECT   25   26   22   22   19                                       
CONECT   26   27   25   45                                            
CONECT   27   28   26   46   47                                       
CONECT   28   29   27   48   49                                       
CONECT   29   30   28                                                 
CONECT   30   29   50   51   52                                       
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41   10                                                      
CONECT   42   17                                                      
CONECT   43   19                                                      
CONECT   44   21                                                      
CONECT   45   26                                                      
CONECT   46   27                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   30                                                      
CONECT   51   30                                                      
CONECT   52   30                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
