COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.634   0.350   2.645  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.846  -0.919   3.472  1.00  0.00           C  
HETATM    3  O   UNL     1      -1.496  -0.584   4.700  1.00  0.00           O  
HETATM    4  C   UNL     1      -1.664  -1.805   5.424  1.00  0.00           C  
HETATM    5  C   UNL     1       0.236   1.332   3.432  1.00  0.00           C  
HETATM    6  O   UNL     1       1.501   0.729   3.711  1.00  0.00           O  
HETATM    7  C   UNL     1       2.264   1.690   4.444  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.270   0.543  -3.944  1.00  0.00           N  
HETATM    9  N   UNL     1       0.768  -0.440  -4.472  1.00  0.00           N  
HETATM   10  N   UNL     1       0.032   0.007   1.386  1.00  0.00           N  
HETATM   11  N   UNL     1      -0.683   0.229  -6.172  1.00  0.00           N  
HETATM   12  N   UNL     1       2.309  -1.152  -2.840  1.00  0.00           N  
HETATM   13  C   UNL     1      -1.022   0.444  -2.629  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.389   0.108  -4.825  1.00  0.00           C  
HETATM   15  C   UNL     1       1.103  -0.581  -3.196  1.00  0.00           C  
HETATM   16  C   UNL     1       0.196  -0.137  -2.213  1.00  0.00           C  
HETATM   17  C   UNL     1       0.476  -0.245  -0.787  1.00  0.00           C  
HETATM   18  C   UNL     1       1.556  -0.751  -0.027  1.00  0.00           C  
HETATM   19  C   UNL     1       1.258  -0.584   1.273  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.479   0.224   0.125  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.671   0.787  -0.339  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.939   0.896  -1.666  1.00  0.00           C  
HETATM   23  H   UNL     1      -1.599   0.810   2.432  1.00  0.00           H  
HETATM   24  H   UNL     1       0.118  -1.379   3.685  1.00  0.00           H  
HETATM   25  H   UNL     1      -1.466  -1.618   2.912  1.00  0.00           H  
HETATM   26  H   UNL     1      -2.159  -1.599   6.373  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.274  -2.493   4.839  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.689  -2.253   5.612  1.00  0.00           H  
HETATM   29  H   UNL     1       0.387   2.236   2.843  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.259   1.587   4.368  1.00  0.00           H  
HETATM   31  H   UNL     1       3.242   1.272   4.681  1.00  0.00           H  
HETATM   32  H   UNL     1       2.389   2.590   3.841  1.00  0.00           H  
HETATM   33  H   UNL     1       1.742   1.940   5.367  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.049  -0.083  -6.837  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.522   0.626  -6.452  1.00  0.00           H  
HETATM   36  H   UNL     1       2.772  -1.734  -3.463  1.00  0.00           H  
HETATM   37  H   UNL     1       2.692  -0.972  -1.967  1.00  0.00           H  
HETATM   38  H   UNL     1       2.459  -1.193  -0.421  1.00  0.00           H  
HETATM   39  H   UNL     1       1.890  -0.873   2.099  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.397   1.145   0.375  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.872   1.337  -1.985  1.00  0.00           H  
CONECT    1    2    5   10   23                                       
CONECT    2    1    3   24   25                                       
CONECT    3    2    4                                                 
CONECT    4    3   26   27   28                                       
CONECT    5    1    6   29   30                                       
CONECT    6    5    7                                                 
CONECT    7    6   31   32   33                                       
CONECT    8   13   13   14                                            
CONECT    9   14   14   15                                            
CONECT   10    1   19   20                                            
CONECT   11   14   34   35                                            
CONECT   12   15   36   37                                            
CONECT   13    8    8   16   22                                       
CONECT   14    8    9    9   11                                       
CONECT   15    9   12   16   16                                       
CONECT   16   13   15   15   17                                       
CONECT   17   16   18   20   20                                       
CONECT   18   17   19   19   38                                       
CONECT   19   10   18   18   39                                       
CONECT   20   10   17   17   21                                       
CONECT   21   20   22   22   40                                       
CONECT   22   13   21   21   41                                       
CONECT   23    1                                                      
CONECT   24    2                                                      
CONECT   25    2                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    5                                                      
CONECT   30    5                                                      
CONECT   31    7                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34   11                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   12                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   21                                                      
CONECT   41   22                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
