COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.269   2.508   0.425  1.00  0.00           C  
HETATM    2  N   UNL     1      -4.986   2.195   0.238  1.00  0.00           N  
HETATM    3  C   UNL     1       3.422   0.763  -0.500  1.00  0.00           C  
HETATM    4  C   UNL     1       4.257  -0.286  -0.123  1.00  0.00           C  
HETATM    5  C   UNL     1       3.708  -1.497   0.294  1.00  0.00           C  
HETATM    6  C   UNL     1       2.334  -1.654   0.331  1.00  0.00           C  
HETATM    7  C   UNL     1       2.707  -3.870   1.110  1.00  0.00           C  
HETATM    8  C   UNL     1       5.731  -0.115  -0.164  1.00  0.00           C  
HETATM    9  C   UNL     1       6.692  -1.083   0.186  1.00  0.00           C  
HETATM   10  C   UNL     1       6.401   1.008  -0.555  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.135   3.606   0.562  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.284  -0.225  -0.225  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.670  -1.683  -0.483  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.035  -2.155  -1.793  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.169  -2.555   0.670  1.00  0.00           C  
HETATM   16  C   UNL     1      -8.192  -1.797  -0.585  1.00  0.00           C  
HETATM   17  N   UNL     1      -4.826  -0.116  -0.128  1.00  0.00           N  
HETATM   18  C   UNL     1      -4.237   1.117   0.104  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.477   3.399   0.461  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.832   1.229   0.187  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.015   0.182   0.050  1.00  0.00           N  
HETATM   22  C   UNL     1      -0.708   0.346   0.137  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.145   1.533   0.360  1.00  0.00           N  
HETATM   24  C   UNL     1      -0.870   2.622   0.507  1.00  0.00           C  
HETATM   25  N   UNL     1       0.111  -0.760  -0.010  1.00  0.00           N  
HETATM   26  C   UNL     1       1.502  -0.602  -0.047  1.00  0.00           C  
HETATM   27  O   UNL     1       1.795  -2.835   0.737  1.00  0.00           O  
HETATM   28  C   UNL     1       2.052   0.605  -0.457  1.00  0.00           C  
HETATM   29  N   UNL     1       7.722   0.753  -0.447  1.00  0.00           N  
HETATM   30  C   UNL     1       8.805   1.686  -0.765  1.00  0.00           C  
HETATM   31  N   UNL     1       7.877  -0.559   0.017  1.00  0.00           N  
HETATM   32  H   UNL     1       3.847   1.702  -0.823  1.00  0.00           H  
HETATM   33  H   UNL     1       4.353  -2.312   0.587  1.00  0.00           H  
HETATM   34  H   UNL     1       2.147  -4.755   1.413  1.00  0.00           H  
HETATM   35  H   UNL     1       3.345  -4.116   0.262  1.00  0.00           H  
HETATM   36  H   UNL     1       3.323  -3.529   1.942  1.00  0.00           H  
HETATM   37  H   UNL     1       6.485  -2.084   0.534  1.00  0.00           H  
HETATM   38  H   UNL     1       5.956   1.933  -0.889  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.743   4.596   0.744  1.00  0.00           H  
HETATM   40  H   UNL     1      -6.641   0.396  -1.047  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.736   0.111   0.707  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.950  -2.074  -1.720  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.310  -3.194  -1.976  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.392  -1.534  -2.614  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.622  -2.218   1.603  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.444  -3.593   0.487  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.084  -2.474   0.743  1.00  0.00           H  
HETATM   48  H   UNL     1      -8.549  -1.176  -1.406  1.00  0.00           H  
HETATM   49  H   UNL     1      -8.467  -2.836  -0.768  1.00  0.00           H  
HETATM   50  H   UNL     1      -8.645  -1.461   0.348  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.273  -0.907  -0.226  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.147   4.240   0.565  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.402   3.579   0.687  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.278  -1.645  -0.086  1.00  0.00           H  
HETATM   55  H   UNL     1       1.406   1.420  -0.750  1.00  0.00           H  
HETATM   56  H   UNL     1       9.062   2.261   0.124  1.00  0.00           H  
HETATM   57  H   UNL     1       9.679   1.127  -1.101  1.00  0.00           H  
HETATM   58  H   UNL     1       8.482   2.363  -1.555  1.00  0.00           H  
CONECT    1   11   11   20   24                                       
CONECT    2   19   19   18                                            
CONECT    3   28   28    4   32                                       
CONECT    4    3    8    5    5                                       
CONECT    5    4    4    6   33                                       
CONECT    6   26   26    5   27                                       
CONECT    7   27   34   35   36                                       
CONECT    8   10   10    4    9                                       
CONECT    9    8   31   31   37                                       
CONECT   10    8    8   29   38                                       
CONECT   11   19    1    1   39                                       
CONECT   12   13   17   40   41                                       
CONECT   13   16   14   12   15                                       
CONECT   14   13   42   43   44                                       
CONECT   15   13   45   46   47                                       
CONECT   16   13   48   49   50                                       
CONECT   17   12   18   51                                            
CONECT   18    2   17   20   20                                       
CONECT   19    2    2   11   52                                       
CONECT   20   18   18    1   21                                       
CONECT   21   20   22   22                                            
CONECT   22   21   21   23   25                                       
CONECT   23   24   24   22                                            
CONECT   24    1   23   23   53                                       
CONECT   25   22   26   54                                            
CONECT   26   28   25    6    6                                       
CONECT   27    6    7                                                 
CONECT   28    3    3   26   55                                       
CONECT   29   10   30   31                                            
CONECT   30   29   56   57   58                                       
CONECT   31   29    9    9                                            
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    7                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   14                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   17                                                      
CONECT   52   19                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
CONECT   55   28                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
