COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.237  -2.108   1.700  1.00  0.00           C  
HETATM    2  C   UNL     1       3.200  -2.704   0.271  1.00  0.00           C  
HETATM    3  C   UNL     1       1.908  -2.131  -0.345  1.00  0.00           C  
HETATM    4  C   UNL     1       1.588  -0.839   0.426  1.00  0.00           C  
HETATM    5  C   UNL     1       2.698  -0.672   1.485  1.00  0.00           C  
HETATM    6  C   UNL     1       2.128  -1.817  -1.826  1.00  0.00           C  
HETATM    7  C   UNL     1       0.762  -3.133  -0.186  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.890  -1.644  -0.221  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.032  -2.419  -0.220  1.00  0.00           C  
HETATM   10  C   UNL     1       2.766   2.883  -0.211  1.00  0.00           C  
HETATM   11  C   UNL     1      -5.229   0.312   0.217  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.623   1.229  -0.123  1.00  0.00           C  
HETATM   13  N   UNL     1      -1.415   2.331   0.128  1.00  0.00           N  
HETATM   14  N   UNL     1      -0.829   3.596   0.264  1.00  0.00           N  
HETATM   15  C   UNL     1       0.456   3.765   0.160  1.00  0.00           C  
HETATM   16  C   UNL     1       1.318   2.673  -0.096  1.00  0.00           C  
HETATM   17  C   UNL     1       0.777   1.390  -0.239  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.443   0.119  -0.207  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.758   0.567  -0.002  1.00  0.00           C  
HETATM   20  C   UNL     1      -2.702   1.932   0.196  1.00  0.00           C  
HETATM   21  N   UNL     1       1.591   0.306  -0.489  1.00  0.00           N  
HETATM   22  N   UNL     1       3.292   4.100   0.036  1.00  0.00           N  
HETATM   23  O   UNL     1       3.492   1.959  -0.528  1.00  0.00           O  
HETATM   24  C   UNL     1      -3.983  -0.271  -0.002  1.00  0.00           C  
HETATM   25  N   UNL     1       4.374  -2.269  -0.498  1.00  0.00           N  
HETATM   26  C   UNL     1      -6.268  -1.834  -0.007  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.366  -0.471   0.206  1.00  0.00           C  
HETATM   28  C   UNL     1       3.134  -4.232   0.330  1.00  0.00           C  
HETATM   29  H   UNL     1       2.585  -2.669   2.370  1.00  0.00           H  
HETATM   30  H   UNL     1       4.256  -2.084   2.086  1.00  0.00           H  
HETATM   31  H   UNL     1       0.617  -0.925   0.913  1.00  0.00           H  
HETATM   32  H   UNL     1       2.284  -0.276   2.412  1.00  0.00           H  
HETATM   33  H   UNL     1       3.488  -0.020   1.110  1.00  0.00           H  
HETATM   34  H   UNL     1       2.403  -2.730  -2.355  1.00  0.00           H  
HETATM   35  H   UNL     1       1.210  -1.412  -2.252  1.00  0.00           H  
HETATM   36  H   UNL     1       2.929  -1.084  -1.927  1.00  0.00           H  
HETATM   37  H   UNL     1       0.597  -3.331   0.873  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.146  -2.719  -0.625  1.00  0.00           H  
HETATM   39  H   UNL     1       1.019  -4.062  -0.694  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.926  -2.101  -0.387  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.961  -3.484  -0.386  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.307   1.376   0.383  1.00  0.00           H  
HETATM   43  H   UNL     1       0.872   4.756   0.272  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.132  -0.899  -0.395  1.00  0.00           H  
HETATM   45  H   UNL     1      -3.550   2.574   0.382  1.00  0.00           H  
HETATM   46  H   UNL     1       2.166   0.301  -1.270  1.00  0.00           H  
HETATM   47  H   UNL     1       2.713   4.836   0.289  1.00  0.00           H  
HETATM   48  H   UNL     1       4.249   4.239  -0.040  1.00  0.00           H  
HETATM   49  H   UNL     1       5.224  -2.640  -0.101  1.00  0.00           H  
HETATM   50  H   UNL     1       4.285  -2.527  -1.469  1.00  0.00           H  
HETATM   51  H   UNL     1      -7.159  -2.444  -0.007  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.332  -0.020   0.375  1.00  0.00           H  
HETATM   53  H   UNL     1       3.015  -4.630  -0.678  1.00  0.00           H  
HETATM   54  H   UNL     1       4.054  -4.619   0.768  1.00  0.00           H  
HETATM   55  H   UNL     1       2.284  -4.535   0.943  1.00  0.00           H  
CONECT    1    2    5   29   30                                       
CONECT    2   25   28    3    1                                       
CONECT    3    7    6    2    4                                       
CONECT    4    3   21    5   31                                       
CONECT    5    1    4   32   33                                       
CONECT    6    3   34   35   36                                       
CONECT    7    3   37   38   39                                       
CONECT    8   24   24    9   40                                       
CONECT    9   26   26    8   41                                       
CONECT   10   23   23   16   22                                       
CONECT   11   27   27   24   42                                       
CONECT   12   17   18   18   13                                       
CONECT   13   12   14   20                                            
CONECT   14   15   15   13                                            
CONECT   15   16   14   14   43                                       
CONECT   16   10   17   17   15                                       
CONECT   17   21   16   16   12                                       
CONECT   18   12   12   19   44                                       
CONECT   19   18   24   20   20                                       
CONECT   20   19   19   13   45                                       
CONECT   21    4   17   46                                            
CONECT   22   10   47   48                                            
CONECT   23   10   10                                                 
CONECT   24   11   19    8    8                                       
CONECT   25    2   49   50                                            
CONECT   26   27    9    9   51                                       
CONECT   27   11   11   26   52                                       
CONECT   28    2   53   54   55                                       
CONECT   29    1                                                      
CONECT   30    1                                                      
CONECT   31    4                                                      
CONECT   32    5                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    6                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    9                                                      
CONECT   42   11                                                      
CONECT   43   15                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   25                                                      
CONECT   50   25                                                      
CONECT   51   26                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
