COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -6.697   0.099   0.946  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.411  -0.732   0.936  1.00  0.00           C  
HETATM    3  N   UNL     1      -4.405  -0.060   0.101  1.00  0.00           N  
HETATM    4  C   UNL     1      -4.901   0.117  -1.271  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.192   0.941  -1.239  1.00  0.00           C  
HETATM    6  O   UNL     1      -7.147   0.289  -0.398  1.00  0.00           O  
HETATM    7  C   UNL     1      -3.195  -0.763   0.111  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.079  -1.936   0.845  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.885  -2.629   0.854  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.800  -2.154   0.129  1.00  0.00           C  
HETATM   11  N   UNL     1       0.410  -2.857   0.138  1.00  0.00           N  
HETATM   12  C   UNL     1       1.611  -2.170   0.054  1.00  0.00           C  
HETATM   13  N   UNL     1       1.623  -0.854   0.076  1.00  0.00           N  
HETATM   14  C   UNL     1       2.777  -0.167  -0.004  1.00  0.00           C  
HETATM   15  C   UNL     1       3.970  -0.809  -0.110  1.00  0.00           C  
HETATM   16  N   UNL     1       4.007  -2.177  -0.137  1.00  0.00           N  
HETATM   17  C   UNL     1       5.015  -3.086  -0.233  1.00  0.00           C  
HETATM   18  C   UNL     1       4.447  -4.316  -0.209  1.00  0.00           C  
HETATM   19  N   UNL     1       3.126  -4.170  -0.101  1.00  0.00           N  
HETATM   20  C   UNL     1       2.834  -2.882  -0.049  1.00  0.00           C  
HETATM   21  C   UNL     1       2.746   1.316   0.024  1.00  0.00           C  
HETATM   22  C   UNL     1       3.942   2.039  -0.065  1.00  0.00           C  
HETATM   23  C   UNL     1       3.931   3.400  -0.041  1.00  0.00           C  
HETATM   24  C   UNL     1       2.716   4.090   0.073  1.00  0.00           C  
HETATM   25  C   UNL     1       2.378   5.463   0.125  1.00  0.00           C  
HETATM   26  N   UNL     1       1.086   5.571   0.235  1.00  0.00           N  
HETATM   27  N   UNL     1       0.504   4.298   0.262  1.00  0.00           N  
HETATM   28  C   UNL     1       1.509   3.369   0.162  1.00  0.00           C  
HETATM   29  C   UNL     1       1.532   1.980   0.132  1.00  0.00           C  
HETATM   30  C   UNL     1      -0.917  -0.981  -0.606  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.112  -0.290  -0.619  1.00  0.00           C  
HETATM   32  H   UNL     1      -7.464  -0.424   1.517  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.500   1.069   1.404  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.034  -0.830   1.954  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.621  -1.721   0.528  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.151   0.640  -1.865  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.102  -0.858  -1.714  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.980   1.935  -0.846  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.594   1.027  -2.249  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.922  -2.305   1.409  1.00  0.00           H  
HETATM   41  H   UNL     1      -1.794  -3.541   1.426  1.00  0.00           H  
HETATM   42  H   UNL     1       0.409  -3.825   0.203  1.00  0.00           H  
HETATM   43  H   UNL     1       4.887  -0.242  -0.174  1.00  0.00           H  
HETATM   44  H   UNL     1       6.070  -2.869  -0.314  1.00  0.00           H  
HETATM   45  H   UNL     1       4.976  -5.256  -0.268  1.00  0.00           H  
HETATM   46  H   UNL     1       4.881   1.512  -0.153  1.00  0.00           H  
HETATM   47  H   UNL     1       4.859   3.949  -0.109  1.00  0.00           H  
HETATM   48  H   UNL     1       3.077   6.286   0.080  1.00  0.00           H  
HETATM   49  H   UNL     1       0.611   1.419   0.196  1.00  0.00           H  
HETATM   50  H   UNL     1      -0.073  -0.611  -1.170  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.204   0.619  -1.194  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.444   4.106   0.339  1.00  0.00           H  
CONECT    1    6    2   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    4    2    7                                            
CONECT    4    5    3   36   37                                       
CONECT    5    6    4   38   39                                       
CONECT    6    1    5                                                 
CONECT    7    8    3   31   31                                       
CONECT    8    9    9    7   40                                       
CONECT    9    8    8   10   41                                       
CONECT   10    9   11   30   30                                       
CONECT   11   10   12   42                                            
CONECT   12   11   20   13   13                                       
CONECT   13   12   12   14                                            
CONECT   14   13   15   15   21                                       
CONECT   15   16   14   14   43                                       
CONECT   16   20   17   15                                            
CONECT   17   18   18   16   44                                       
CONECT   18   19   17   17   45                                       
CONECT   19   18   20   20                                            
CONECT   20   19   19   12   16                                       
CONECT   21   14   22   22   29                                       
CONECT   22   21   21   23   46                                       
CONECT   23   22   24   24   47                                       
CONECT   24   23   23   28   25                                       
CONECT   25   24   26   26   48                                       
CONECT   26   25   25   27                                            
CONECT   27   28   26   52                                            
CONECT   28   29   29   24   27                                       
CONECT   29   21   28   28   49                                       
CONECT   30   10   10   31   50                                       
CONECT   31    7    7   30   51                                       
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    4                                                      
CONECT   38    5                                                      
CONECT   39    5                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   15                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   22                                                      
CONECT   47   23                                                      
CONECT   48   25                                                      
CONECT   49   29                                                      
CONECT   50   30                                                      
CONECT   51   31                                                      
CONECT   52   27                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
