COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       4.357  -2.517  -1.456  1.00  0.00           C  
HETATM    2  C   UNL     1       3.918  -1.892  -0.131  1.00  0.00           C  
HETATM    3  C   UNL     1       4.508  -2.693   1.032  1.00  0.00           C  
HETATM    4  N   UNL     1       4.393  -0.508  -0.062  1.00  0.00           N  
HETATM    5  C   UNL     1       3.632   0.613   0.064  1.00  0.00           C  
HETATM    6  N   UNL     1       4.450   1.650   0.087  1.00  0.00           N  
HETATM    7  C   UNL     1       5.707   1.234  -0.019  1.00  0.00           C  
HETATM    8  N   UNL     1       5.727  -0.071  -0.106  1.00  0.00           N  
HETATM    9  C   UNL     1       2.165   0.661   0.156  1.00  0.00           C  
HETATM   10  C   UNL     1       1.440   1.738   0.565  1.00  0.00           C  
HETATM   11  C   UNL     1       0.074   1.564   0.575  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.316   0.310   0.162  1.00  0.00           C  
HETATM   13  S   UNL     1       1.081  -0.662  -0.254  1.00  0.00           S  
HETATM   14  C   UNL     1      -1.741  -0.080   0.100  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.197  -1.300   0.586  1.00  0.00           C  
HETATM   16  C   UNL     1      -3.533  -1.593   0.535  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.437  -0.671   0.001  1.00  0.00           C  
HETATM   18  C   UNL     1      -3.984   0.552  -0.504  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.638   0.844  -0.472  1.00  0.00           C  
HETATM   20  O   UNL     1      -2.133   1.967  -1.031  1.00  0.00           O  
HETATM   21  C   UNL     1      -1.749   3.077  -0.218  1.00  0.00           C  
HETATM   22  C   UNL     1      -0.938   2.616   0.991  1.00  0.00           C  
HETATM   23  C   UNL     1      -5.878  -0.990  -0.032  1.00  0.00           C  
HETATM   24  O   UNL     1      -6.667  -0.190  -0.497  1.00  0.00           O  
HETATM   25  N   UNL     1      -6.319  -2.168   0.453  1.00  0.00           N  
HETATM   26  H   UNL     1       5.445  -2.503  -1.521  1.00  0.00           H  
HETATM   27  H   UNL     1       4.003  -3.547  -1.507  1.00  0.00           H  
HETATM   28  H   UNL     1       3.936  -1.947  -2.284  1.00  0.00           H  
HETATM   29  H   UNL     1       2.829  -1.906  -0.065  1.00  0.00           H  
HETATM   30  H   UNL     1       4.195  -2.247   1.976  1.00  0.00           H  
HETATM   31  H   UNL     1       4.154  -3.722   0.981  1.00  0.00           H  
HETATM   32  H   UNL     1       5.596  -2.679   0.966  1.00  0.00           H  
HETATM   33  H   UNL     1       6.578   1.873  -0.027  1.00  0.00           H  
HETATM   34  H   UNL     1       1.905   2.667   0.863  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.501  -2.013   1.001  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.889  -2.541   0.910  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.684   1.263  -0.916  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.147   3.764  -0.812  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.644   3.592   0.129  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.610   2.194   1.738  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.414   3.470   1.421  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.689  -2.806   0.823  1.00  0.00           H  
HETATM   43  H   UNL     1      -7.266  -2.377   0.431  1.00  0.00           H  
CONECT    1    2   26   27   28                                       
CONECT    2    3    1    4   29                                       
CONECT    3    2   30   31   32                                       
CONECT    4    2    8    5                                            
CONECT    5    4    6    6    9                                       
CONECT    6    7    5    5                                            
CONECT    7    8    8    6   33                                       
CONECT    8    4    7    7                                            
CONECT    9    5   13   10   10                                       
CONECT   10    9    9   11   34                                       
CONECT   11   12   12   10   22                                       
CONECT   12   13   14   11   11                                       
CONECT   13    9   12                                                 
CONECT   14   15   12   19   19                                       
CONECT   15   16   16   14   35                                       
CONECT   16   15   15   17   36                                       
CONECT   17   16   23   18   18                                       
CONECT   18   17   17   19   37                                       
CONECT   19   14   14   18   20                                       
CONECT   20   19   21                                                 
CONECT   21   20   22   38   39                                       
CONECT   22   11   21   40   41                                       
CONECT   23   24   24   17   25                                       
CONECT   24   23   23                                                 
CONECT   25   23   42   43                                            
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    3                                                      
CONECT   32    3                                                      
CONECT   33    7                                                      
CONECT   34   10                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   18                                                      
CONECT   38   21                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   25                                                      
CONECT   43   25                                                      
MASTER        0    0    0    0    0    0    0    0   43    0   43    0
END
