COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.081  -0.130  -0.258  1.00  0.00           C  
HETATM    2  C   UNL     1       2.217  -0.857  -0.053  1.00  0.00           C  
HETATM    3  N   UNL     1       2.115  -2.208   0.163  1.00  0.00           N  
HETATM    4  C   UNL     1       4.998   1.618  -0.255  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.530  -0.790  -0.414  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.693   0.174  -0.654  1.00  0.00           C  
HETATM    7  C   UNL     1      -4.532  -0.032  -1.917  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.112  -0.389  -0.547  1.00  0.00           C  
HETATM    9  C   UNL     1      -6.179   0.515   0.015  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.813   2.227  -0.294  1.00  0.00           C  
HETATM   11  N   UNL     1       3.070  -3.203   0.398  1.00  0.00           N  
HETATM   12  C   UNL     1       2.456  -4.354   0.542  1.00  0.00           C  
HETATM   13  C   UNL     1       1.089  -4.156   0.407  1.00  0.00           C  
HETATM   14  N   UNL     1       7.040   2.067  -0.919  1.00  0.00           N  
HETATM   15  C   UNL     1       0.881  -2.805   0.169  1.00  0.00           C  
HETATM   16  N   UNL     1      -0.230  -2.080  -0.033  1.00  0.00           N  
HETATM   17  O   UNL     1      -1.298  -0.067  -0.441  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.162  -0.779  -0.244  1.00  0.00           C  
HETATM   19  N   UNL     1       3.452  -0.243  -0.062  1.00  0.00           N  
HETATM   20  C   UNL     1       3.550   1.200  -0.294  1.00  0.00           C  
HETATM   21  C   UNL     1       5.683   2.012   0.843  1.00  0.00           C  
HETATM   22  C   UNL     1      -6.833   1.400  -0.821  1.00  0.00           C  
HETATM   23  C   UNL     1      -8.099   2.133   1.060  1.00  0.00           C  
HETATM   24  C   UNL     1      -7.406   1.220   1.832  1.00  0.00           C  
HETATM   25  N   UNL     1      -6.480   0.449   1.297  1.00  0.00           N  
HETATM   26  N   UNL     1       6.946   2.294   0.460  1.00  0.00           N  
HETATM   27  C   UNL     1       5.871   1.661  -1.347  1.00  0.00           C  
HETATM   28  C   UNL     1       8.028   2.757   1.332  1.00  0.00           C  
HETATM   29  H   UNL     1       1.137   0.936  -0.425  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.649  -1.269   0.558  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.522  -1.551  -1.195  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.532   1.198  -0.319  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.923   0.857  -2.412  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.256  -0.854  -2.577  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.216  -1.447  -0.305  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.341   2.929  -0.923  1.00  0.00           H  
HETATM   37  H   UNL     1       2.937  -5.302   0.734  1.00  0.00           H  
HETATM   38  H   UNL     1       0.324  -4.916   0.476  1.00  0.00           H  
HETATM   39  H   UNL     1       4.255  -0.766   0.084  1.00  0.00           H  
HETATM   40  H   UNL     1       2.998   1.731   0.481  1.00  0.00           H  
HETATM   41  H   UNL     1       3.129   1.441  -1.270  1.00  0.00           H  
HETATM   42  H   UNL     1       5.290   2.087   1.846  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.585   1.447  -1.870  1.00  0.00           H  
HETATM   44  H   UNL     1      -8.856   2.762   1.504  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.623   1.140   2.887  1.00  0.00           H  
HETATM   46  H   UNL     1       5.625   1.401  -2.365  1.00  0.00           H  
HETATM   47  H   UNL     1       8.569   1.897   1.728  1.00  0.00           H  
HETATM   48  H   UNL     1       8.712   3.385   0.761  1.00  0.00           H  
HETATM   49  H   UNL     1       7.609   3.333   2.157  1.00  0.00           H  
CONECT    1    2    2   18   29                                       
CONECT    2    3   19    1    1                                       
CONECT    3   11   15    2                                            
CONECT    4   21   21   20   27                                       
CONECT    5   17    6   30   31                                       
CONECT    6    5    8    7   32                                       
CONECT    7    6    8   33   34                                       
CONECT    8    6    7    9   35                                       
CONECT    9    8   25   25   22                                       
CONECT   10   22   22   23   36                                       
CONECT   11   12   12    3                                            
CONECT   12   11   11   13   37                                       
CONECT   13   12   15   15   38                                       
CONECT   14   26   27   27                                            
CONECT   15   13   13    3   16                                       
CONECT   16   15   18   18                                            
CONECT   17   18    5                                                 
CONECT   18   16   16    1   17                                       
CONECT   19    2   20   39                                            
CONECT   20   19    4   40   41                                       
CONECT   21    4    4   26   42                                       
CONECT   22    9   10   10   43                                       
CONECT   23   24   24   10   44                                       
CONECT   24   25   23   23   45                                       
CONECT   25    9    9   24                                            
CONECT   26   21   28   14                                            
CONECT   27    4   14   14   46                                       
CONECT   28   26   47   48   49                                       
CONECT   29    1                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    7                                                      
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36   10                                                      
CONECT   37   12                                                      
CONECT   38   13                                                      
CONECT   39   19                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   27                                                      
CONECT   47   28                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
