COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.591  -1.230   0.004  1.00  0.00           C  
HETATM    2  C   UNL     1       0.364  -0.220  -0.125  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.183  -2.559   0.131  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.030  -0.893   0.014  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.045  -1.786   0.140  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.263  -1.064   0.103  1.00  0.00           C  
HETATM    7  C   UNL     1      -3.928   0.296  -0.051  1.00  0.00           C  
HETATM    8  C   UNL     1       4.323  -1.149  -0.007  1.00  0.00           C  
HETATM    9  C   UNL     1       5.125  -0.930  -1.120  1.00  0.00           C  
HETATM   10  C   UNL     1       6.037   0.102  -1.122  1.00  0.00           C  
HETATM   11  C   UNL     1       5.347   0.708   1.112  1.00  0.00           C  
HETATM   12  N   UNL     1       7.886   2.245  -1.047  1.00  0.00           N  
HETATM   13  C   UNL     1      -5.609  -1.448   0.185  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.591  -0.506   0.117  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.266   0.848  -0.035  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.935   1.247  -0.119  1.00  0.00           C  
HETATM   17  C   UNL     1      -7.343   1.859  -0.108  1.00  0.00           C  
HETATM   18  C   UNL     1       1.705  -0.538  -0.128  1.00  0.00           C  
HETATM   19  C   UNL     1       2.107  -1.861  -0.002  1.00  0.00           C  
HETATM   20  C   UNL     1       1.160  -2.869   0.127  1.00  0.00           C  
HETATM   21  N   UNL     1      -2.551   0.375  -0.097  1.00  0.00           N  
HETATM   22  O   UNL     1       3.430  -2.171  -0.006  1.00  0.00           O  
HETATM   23  C   UNL     1       6.155   0.930  -0.005  1.00  0.00           C  
HETATM   24  C   UNL     1       4.438  -0.327   1.108  1.00  0.00           C  
HETATM   25  C   UNL     1       7.133   2.039  -0.003  1.00  0.00           C  
HETATM   26  N   UNL     1       7.248   2.855   1.101  1.00  0.00           N  
HETATM   27  N   UNL     1      -7.044   3.120  -0.250  1.00  0.00           N  
HETATM   28  N   UNL     1      -8.662   1.468  -0.025  1.00  0.00           N  
HETATM   29  H   UNL     1       0.052   0.809  -0.224  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.919  -3.344   0.232  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.941  -2.855   0.249  1.00  0.00           H  
HETATM   32  H   UNL     1       5.034  -1.571  -1.985  1.00  0.00           H  
HETATM   33  H   UNL     1       6.661   0.271  -1.988  1.00  0.00           H  
HETATM   34  H   UNL     1       5.436   1.346   1.979  1.00  0.00           H  
HETATM   35  H   UNL     1       8.528   2.973  -1.046  1.00  0.00           H  
HETATM   36  H   UNL     1      -5.867  -2.490   0.302  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.626  -0.805   0.181  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.688   2.291  -0.236  1.00  0.00           H  
HETATM   39  H   UNL     1       2.444   0.243  -0.229  1.00  0.00           H  
HETATM   40  H   UNL     1       1.477  -3.897   0.225  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.035   1.191  -0.198  1.00  0.00           H  
HETATM   42  H   UNL     1       3.812  -0.499   1.972  1.00  0.00           H  
HETATM   43  H   UNL     1       6.687   2.702   1.878  1.00  0.00           H  
HETATM   44  H   UNL     1       7.889   3.583   1.102  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.116   3.395  -0.308  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.884   0.530   0.080  1.00  0.00           H  
HETATM   47  H   UNL     1      -9.368   2.131  -0.073  1.00  0.00           H  
CONECT    1    4    3    3    2                                       
CONECT    2    1   18   18   29                                       
CONECT    3    1    1   20   30                                       
CONECT    4   21    5    5    1                                       
CONECT    5    6    4    4   31                                       
CONECT    6   13   13    7    5                                       
CONECT    7   16   16    6   21                                       
CONECT    8   22    9    9   24                                       
CONECT    9    8    8   10   32                                       
CONECT   10    9   23   23   33                                       
CONECT   11   24   24   23   34                                       
CONECT   12   25   25   35                                            
CONECT   13   14    6    6   36                                       
CONECT   14   15   15   13   37                                       
CONECT   15   17   14   14   16                                       
CONECT   16   15    7    7   38                                       
CONECT   17   27   27   28   15                                       
CONECT   18    2    2   19   39                                       
CONECT   19   20   20   18   22                                       
CONECT   20    3   19   19   40                                       
CONECT   21    7    4   41                                            
CONECT   22   19    8                                                 
CONECT   23   10   10   11   25                                       
CONECT   24    8   11   11   42                                       
CONECT   25   23   12   12   26                                       
CONECT   26   25   43   44                                            
CONECT   27   17   17   45                                            
CONECT   28   17   46   47                                            
CONECT   29    2                                                      
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    9                                                      
CONECT   33   10                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   16                                                      
CONECT   39   18                                                      
CONECT   40   20                                                      
CONECT   41   21                                                      
CONECT   42   24                                                      
CONECT   43   26                                                      
CONECT   44   26                                                      
CONECT   45   27                                                      
CONECT   46   28                                                      
CONECT   47   28                                                      
MASTER        0    0    0    0    0    0    0    0   47    0   47    0
END
