COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.714  -2.377  -0.347  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.748  -1.300  -0.516  1.00  0.00           C  
HETATM    3  C   UNL     1       1.592  -0.789  -0.336  1.00  0.00           C  
HETATM    4  C   UNL     1       0.779  -2.865   0.547  1.00  0.00           C  
HETATM    5  C   UNL     1       4.141  -0.296   1.547  1.00  0.00           C  
HETATM    6  C   UNL     1       4.685   1.288  -0.344  1.00  0.00           C  
HETATM    7  O   UNL     1      -5.162  -0.220   0.029  1.00  0.00           O  
HETATM    8  C   UNL     1      -4.330   0.829   0.250  1.00  0.00           C  
HETATM    9  N   UNL     1      -4.658   1.748   1.142  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.877   2.784   1.388  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.683   2.945   0.715  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.303   2.001  -0.229  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.140   0.924  -0.460  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.768  -0.129  -1.472  1.00  0.00           C  
HETATM   15  N   UNL     1      -2.096  -1.241  -0.795  1.00  0.00           N  
HETATM   16  C   UNL     1      -1.814  -3.191   0.230  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.513  -2.525   0.139  1.00  0.00           C  
HETATM   18  C   UNL     1       0.313  -0.436  -0.750  1.00  0.00           C  
HETATM   19  C   UNL     1       1.815  -2.009   0.312  1.00  0.00           C  
HETATM   20  C   UNL     1       2.727   0.131  -0.585  1.00  0.00           C  
HETATM   21  C   UNL     1       3.885   0.343   0.291  1.00  0.00           C  
HETATM   22  N   UNL     1       4.344  -0.802   2.543  1.00  0.00           N  
HETATM   23  N   UNL     1       4.077   1.626  -1.499  1.00  0.00           N  
HETATM   24  N   UNL     1       2.884   0.910  -1.630  1.00  0.00           N  
HETATM   25  N   UNL     1       5.881   1.793   0.127  1.00  0.00           N  
HETATM   26  H   UNL     1      -3.769  -2.586  -0.438  1.00  0.00           H  
HETATM   27  H   UNL     1       0.958  -3.804   1.049  1.00  0.00           H  
HETATM   28  H   UNL     1      -4.177   3.515   2.124  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.050   3.796   0.922  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.373   2.104  -0.769  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.669  -0.494  -1.964  1.00  0.00           H  
HETATM   32  H   UNL     1      -2.097   0.302  -2.215  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.013  -4.154   0.676  1.00  0.00           H  
HETATM   34  H   UNL     1       0.145   0.506  -1.250  1.00  0.00           H  
HETATM   35  H   UNL     1       2.812  -2.274   0.629  1.00  0.00           H  
HETATM   36  H   UNL     1       4.417   2.268  -2.142  1.00  0.00           H  
HETATM   37  H   UNL     1       6.365   2.456  -0.390  1.00  0.00           H  
HETATM   38  H   UNL     1       6.238   1.485   0.975  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.819  -0.062  -0.663  1.00  0.00           H  
CONECT    1   15   16   16   26                                       
CONECT    2   18   18   17   15                                       
CONECT    3   20   19   19   18                                       
CONECT    4   19   17   17   27                                       
CONECT    5   22   22   22   21                                       
CONECT    6   25   23   21   21                                       
CONECT    7    8   39                                                 
CONECT    8    7   13    9    9                                       
CONECT    9    8    8   10                                            
CONECT   10    9   11   11   28                                       
CONECT   11   12   10   10   29                                       
CONECT   12   13   13   11   30                                       
CONECT   13   14    8   12   12                                       
CONECT   14   15   13   31   32                                       
CONECT   15    2   14    1                                            
CONECT   16   17    1    1   33                                       
CONECT   17    4    4    2   16                                       
CONECT   18    3    2    2   34                                       
CONECT   19    3    3    4   35                                       
CONECT   20   21   24   24    3                                       
CONECT   21    6    6    5   20                                       
CONECT   22    5    5    5                                            
CONECT   23    6   24   36                                            
CONECT   24   23   20   20                                            
CONECT   25    6   37   38                                            
CONECT   26    1                                                      
CONECT   27    4                                                      
CONECT   28   10                                                      
CONECT   29   11                                                      
CONECT   30   12                                                      
CONECT   31   14                                                      
CONECT   32   14                                                      
CONECT   33   16                                                      
CONECT   34   18                                                      
CONECT   35   19                                                      
CONECT   36   23                                                      
CONECT   37   25                                                      
CONECT   38   25                                                      
CONECT   39    7                                                      
MASTER        0    0    0    0    0    0    0    0   39    0   39    0
END
