COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -2.894  -0.830  -0.885  1.00  0.00           N  
HETATM    2  C   UNL     1       4.840  -0.234   0.342  1.00  0.00           C  
HETATM    3  C   UNL     1       2.774  -0.842   0.247  1.00  0.00           C  
HETATM    4  C   UNL     1       3.164  -0.942   1.531  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.473  -0.497  -2.164  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.951  -2.561  -0.150  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.199  -0.125  -2.092  1.00  0.00           C  
HETATM    8  C   UNL     1       6.186   0.237  -0.051  1.00  0.00           C  
HETATM    9  C   UNL     1       2.315  -1.394   2.691  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.520   1.715  -0.742  1.00  0.00           C  
HETATM   11  C   UNL     1       6.456   0.553  -1.383  1.00  0.00           C  
HETATM   12  C   UNL     1       8.442   0.813   0.536  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.473   3.077  -0.514  1.00  0.00           C  
HETATM   14  C   UNL     1      -4.170  -1.273  -0.529  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.853  -0.658  -0.046  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.184  -0.503  -0.048  1.00  0.00           N  
HETATM   17  N   UNL     1       3.822  -0.406  -0.468  1.00  0.00           N  
HETATM   18  O   UNL     1       4.457  -0.563   1.587  1.00  0.00           O  
HETATM   19  N   UNL     1      -0.802  -0.220  -0.766  1.00  0.00           N  
HETATM   20  N   UNL     1      -6.284  -1.339   0.181  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.627  -2.553  -0.598  1.00  0.00           C  
HETATM   22  C   UNL     1       1.404  -1.163  -0.291  1.00  0.00           C  
HETATM   23  O   UNL     1      -1.862  -0.861   1.155  1.00  0.00           O  
HETATM   24  C   UNL     1      -5.135   0.879   0.180  1.00  0.00           C  
HETATM   25  C   UNL     1       0.530   0.092  -0.243  1.00  0.00           C  
HETATM   26  C   UNL     1      -5.701   1.415   1.329  1.00  0.00           C  
HETATM   27  C   UNL     1       7.189   0.373   0.910  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.651   2.777   1.552  1.00  0.00           C  
HETATM   29  C   UNL     1       7.714   0.992  -1.743  1.00  0.00           C  
HETATM   30  C   UNL     1       8.705   1.118  -0.787  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.033   3.606   0.635  1.00  0.00           C  
HETATM   32  H   UNL     1      -3.075  -0.533  -3.061  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.590  -3.429  -0.085  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.582   0.194  -2.919  1.00  0.00           H  
HETATM   35  H   UNL     1       2.402  -2.474   2.806  1.00  0.00           H  
HETATM   36  H   UNL     1       2.654  -0.902   3.603  1.00  0.00           H  
HETATM   37  H   UNL     1       1.274  -1.132   2.502  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.083   1.302  -1.639  1.00  0.00           H  
HETATM   39  H   UNL     1       5.683   0.453  -2.131  1.00  0.00           H  
HETATM   40  H   UNL     1       9.220   0.914   1.278  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.999   3.728  -1.233  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.066  -3.410  -0.939  1.00  0.00           H  
HETATM   43  H   UNL     1       1.490  -1.506  -1.322  1.00  0.00           H  
HETATM   44  H   UNL     1       0.949  -1.946   0.316  1.00  0.00           H  
HETATM   45  H   UNL     1       0.984   0.875  -0.850  1.00  0.00           H  
HETATM   46  H   UNL     1       0.444   0.435   0.788  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.181   0.767   2.049  1.00  0.00           H  
HETATM   48  H   UNL     1       6.984   0.135   1.943  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.091   3.194   2.446  1.00  0.00           H  
HETATM   50  H   UNL     1       7.924   1.236  -2.774  1.00  0.00           H  
HETATM   51  H   UNL     1       9.688   1.463  -1.074  1.00  0.00           H  
HETATM   52  H   UNL     1      -4.995   4.671   0.811  1.00  0.00           H  
CONECT    1   14   15    5                                            
CONECT    2   17   17    8   18                                       
CONECT    3   17   22    4    4                                       
CONECT    4    3    3   18    9                                       
CONECT    5    1    7    7   32                                       
CONECT    6   20   20   21   33                                       
CONECT    7   19    5    5   34                                       
CONECT    8    2   27   27   11                                       
CONECT    9    4   35   36   37                                       
CONECT   10   24   24   13   38                                       
CONECT   11    8   29   29   39                                       
CONECT   12   27   30   30   40                                       
CONECT   13   10   31   31   41                                       
CONECT   14    1   21   21   16                                       
CONECT   15    1   19   23   23                                       
CONECT   16   14   24   20                                            
CONECT   17    2    2    3                                            
CONECT   18    2    4                                                 
CONECT   19   15   25    7                                            
CONECT   20   16    6    6                                            
CONECT   21   14   14    6   42                                       
CONECT   22    3   25   43   44                                       
CONECT   23   15   15                                                 
CONECT   24   16   10   10   26                                       
CONECT   25   19   22   45   46                                       
CONECT   26   24   28   28   47                                       
CONECT   27    8    8   12   48                                       
CONECT   28   26   26   31   49                                       
CONECT   29   11   11   30   50                                       
CONECT   30   12   12   29   51                                       
CONECT   31   28   13   13   52                                       
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    7                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   21                                                      
CONECT   43   22                                                      
CONECT   44   22                                                      
CONECT   45   25                                                      
CONECT   46   25                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   30                                                      
CONECT   52   31                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
