COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.466   0.278  -1.193  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.096   0.168  -1.261  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.293   1.056  -0.549  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.897   2.059   0.233  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.295   2.151   0.285  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.060   1.273  -0.425  1.00  0.00           C  
HETATM    7  N   UNL     1      -1.932   1.196  -0.419  1.00  0.00           N  
HETATM    8  C   UNL     1      -1.673   2.261   0.423  1.00  0.00           C  
HETATM    9  C   UNL     1      -2.852   2.799   0.836  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.922   0.356  -1.067  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.690  -0.880  -0.237  1.00  0.00           C  
HETATM   12  C   UNL     1       0.196  -0.842   0.826  1.00  0.00           C  
HETATM   13  C   UNL     1       0.414  -1.972   1.592  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.251  -3.146   1.301  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.145  -3.191   0.232  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.365  -2.046  -0.534  1.00  0.00           C  
HETATM   17  C   UNL     1      -1.861  -4.447  -0.086  1.00  0.00           C  
HETATM   18  N   UNL     1      -2.779  -4.458  -1.010  1.00  0.00           N  
HETATM   19  N   UNL     1      -1.558  -5.605   0.597  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.338   2.732   0.814  1.00  0.00           C  
HETATM   21  O   UNL     1       0.762   2.149   0.296  1.00  0.00           O  
HETATM   22  C   UNL     1       2.047   2.607   0.792  1.00  0.00           C  
HETATM   23  C   UNL     1       3.152   1.932   0.022  1.00  0.00           C  
HETATM   24  C   UNL     1       3.706   2.557  -1.080  1.00  0.00           C  
HETATM   25  C   UNL     1       4.722   1.944  -1.793  1.00  0.00           C  
HETATM   26  C   UNL     1       5.188   0.704  -1.406  1.00  0.00           C  
HETATM   27  C   UNL     1       4.634   0.069  -0.295  1.00  0.00           C  
HETATM   28  C   UNL     1       3.614   0.694   0.422  1.00  0.00           C  
HETATM   29  C   UNL     1       5.129  -1.262   0.125  1.00  0.00           C  
HETATM   30  N   UNL     1       4.609  -1.853   1.162  1.00  0.00           N  
HETATM   31  N   UNL     1       6.140  -1.875  -0.583  1.00  0.00           N  
HETATM   32  O   UNL     1      -0.225   3.649   1.605  1.00  0.00           O  
HETATM   33  H   UNL     1      -6.086  -0.412  -1.746  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.644  -0.606  -1.864  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.765   2.918   0.883  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.136   1.346  -0.384  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.969   3.642   1.500  1.00  0.00           H  
HETATM   38  H   UNL     1      -1.271   0.067  -2.058  1.00  0.00           H  
HETATM   39  H   UNL     1       0.010   0.913  -1.158  1.00  0.00           H  
HETATM   40  H   UNL     1       0.719   0.074   1.057  1.00  0.00           H  
HETATM   41  H   UNL     1       1.107  -1.936   2.420  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.079  -4.028   1.901  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.059  -2.074  -1.361  1.00  0.00           H  
HETATM   44  H   UNL     1      -3.248  -5.281  -1.218  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.874  -5.597   1.285  1.00  0.00           H  
HETATM   46  H   UNL     1      -2.027  -6.428   0.389  1.00  0.00           H  
HETATM   47  H   UNL     1       2.122   3.687   0.665  1.00  0.00           H  
HETATM   48  H   UNL     1       2.137   2.359   1.850  1.00  0.00           H  
HETATM   49  H   UNL     1       3.345   3.527  -1.387  1.00  0.00           H  
HETATM   50  H   UNL     1       5.150   2.437  -2.653  1.00  0.00           H  
HETATM   51  H   UNL     1       5.981   0.227  -1.963  1.00  0.00           H  
HETATM   52  H   UNL     1       3.181   0.207   1.283  1.00  0.00           H  
HETATM   53  H   UNL     1       3.898  -1.421   1.660  1.00  0.00           H  
HETATM   54  H   UNL     1       6.527  -1.435  -1.356  1.00  0.00           H  
HETATM   55  H   UNL     1       6.465  -2.747  -0.308  1.00  0.00           H  
CONECT    1    6    2    2   33                                       
CONECT    2    3    1    1   34                                       
CONECT    3    4    4    7    2                                       
CONECT    4    9    5    3    3                                       
CONECT    5    4    6    6   35                                       
CONECT    6    5    5    1   36                                       
CONECT    7    8    3   10                                            
CONECT    8   20    9    9    7                                       
CONECT    9    8    8    4   37                                       
CONECT   10    7   11   38   39                                       
CONECT   11   12   10   16   16                                       
CONECT   12   13   13   11   40                                       
CONECT   13   12   12   14   41                                       
CONECT   14   13   15   15   42                                       
CONECT   15   14   14   16   17                                       
CONECT   16   11   11   15   43                                       
CONECT   17   15   18   18   19                                       
CONECT   18   17   17   44                                            
CONECT   19   17   45   46                                            
CONECT   20   21   32   32    8                                       
CONECT   21   22   20                                                 
CONECT   22   23   21   47   48                                       
CONECT   23   28   22   24   24                                       
CONECT   24   23   23   25   49                                       
CONECT   25   26   26   24   50                                       
CONECT   26   27   25   25   51                                       
CONECT   27   29   28   28   26                                       
CONECT   28   27   27   23   52                                       
CONECT   29   30   30   31   27                                       
CONECT   30   29   29   53                                            
CONECT   31   29   54   55                                            
CONECT   32   20   20                                                 
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    5                                                      
CONECT   36    6                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   18                                                      
CONECT   45   19                                                      
CONECT   46   19                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   24                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   28                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   31                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
