COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.743  -2.507  -0.124  1.00  0.00           C  
HETATM    2  C   UNL     1       0.018  -1.341   0.029  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.929  -0.123   0.144  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.123  -2.405  -0.134  1.00  0.00           C  
HETATM    5  C   UNL     1       3.009  -0.302  -1.016  1.00  0.00           C  
HETATM    6  C   UNL     1       4.088   0.545  -0.904  1.00  0.00           C  
HETATM    7  C   UNL     1       4.619   0.836   0.357  1.00  0.00           C  
HETATM    8  C   UNL     1       4.050   0.262   1.500  1.00  0.00           C  
HETATM    9  C   UNL     1       2.971  -0.584   1.379  1.00  0.00           C  
HETATM   10  C   UNL     1       2.447  -0.870   0.122  1.00  0.00           C  
HETATM   11  C   UNL     1       2.432  -0.610  -2.374  1.00  0.00           C  
HETATM   12  C   UNL     1       2.357  -1.202   2.608  1.00  0.00           C  
HETATM   13  C   UNL     1       5.772   1.740   0.482  1.00  0.00           C  
HETATM   14  C   UNL     1       6.319   2.292  -0.621  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.936   1.209   0.158  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.613   0.382  -0.734  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.981   0.477  -0.860  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.689   1.405  -0.091  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.006   2.234   0.804  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.639   2.130   0.929  1.00  0.00           C  
HETATM   21  C   UNL     1      -8.112   1.507  -0.220  1.00  0.00           C  
HETATM   22  C   UNL     1       1.405  -3.062  -0.154  1.00  0.00           C  
HETATM   23  C   UNL     1       7.442   3.172  -0.500  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.605  -0.178   0.159  1.00  0.00           N  
HETATM   25  N   UNL     1      -2.676  -1.207   0.002  1.00  0.00           N  
HETATM   26  N   UNL     1       0.158  -3.564  -0.233  1.00  0.00           N  
HETATM   27  N   UNL     1      -2.552   1.109   0.283  1.00  0.00           N  
HETATM   28  N   UNL     1       1.347  -1.725   0.004  1.00  0.00           N  
HETATM   29  N   UNL     1       8.333   3.871  -0.403  1.00  0.00           N  
HETATM   30  N   UNL     1      -9.241   1.587  -0.322  1.00  0.00           N  
HETATM   31  O   UNL     1       2.429  -3.716  -0.213  1.00  0.00           O  
HETATM   32  H   UNL     1      -2.739  -3.284  -0.251  1.00  0.00           H  
HETATM   33  H   UNL     1       4.524   0.985  -1.789  1.00  0.00           H  
HETATM   34  H   UNL     1       4.457   0.483   2.476  1.00  0.00           H  
HETATM   35  H   UNL     1       1.658   0.119  -2.614  1.00  0.00           H  
HETATM   36  H   UNL     1       3.222  -0.563  -3.124  1.00  0.00           H  
HETATM   37  H   UNL     1       1.999  -1.611  -2.366  1.00  0.00           H  
HETATM   38  H   UNL     1       1.571  -0.550   2.989  1.00  0.00           H  
HETATM   39  H   UNL     1       1.932  -2.173   2.353  1.00  0.00           H  
HETATM   40  H   UNL     1       3.125  -1.331   3.372  1.00  0.00           H  
HETATM   41  H   UNL     1       6.181   1.962   1.457  1.00  0.00           H  
HETATM   42  H   UNL     1       5.910   2.069  -1.596  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.065  -0.334  -1.328  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.506  -0.164  -1.552  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.550   2.952   1.399  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.110   2.769   1.620  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.073  -4.499  -0.347  1.00  0.00           H  
HETATM   48  H   UNL     1      -2.024   1.902   0.468  1.00  0.00           H  
CONECT    1    2   26    4    4                                       
CONECT    2   28   24   24    1                                       
CONECT    3   24   27   25   25                                       
CONECT    4    1    1   25   32                                       
CONECT    5    6    6   10   11                                       
CONECT    6    7    5    5   33                                       
CONECT    7   13    8    8    6                                       
CONECT    8    7    7    9   34                                       
CONECT    9    8   12   10   10                                       
CONECT   10    9    9    5   28                                       
CONECT   11    5   35   36   37                                       
CONECT   12    9   38   39   40                                       
CONECT   13   14   14    7   41                                       
CONECT   14   23   13   13   42                                       
CONECT   15   20   20   16   27                                       
CONECT   16   17   17   15   43                                       
CONECT   17   18   16   16   44                                       
CONECT   18   21   19   19   17                                       
CONECT   19   18   18   20   45                                       
CONECT   20   19   15   15   46                                       
CONECT   21   30   30   30   18                                       
CONECT   22   31   31   28   26                                       
CONECT   23   29   29   29   14                                       
CONECT   24    2    2    3                                            
CONECT   25    3    3    4                                            
CONECT   26   22    1   47                                            
CONECT   27   15    3   48                                            
CONECT   28   10   22    2                                            
CONECT   29   23   23   23                                            
CONECT   30   21   21   21                                            
CONECT   31   22   22                                                 
CONECT   32    4                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35   11                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   13                                                      
CONECT   42   14                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   19                                                      
CONECT   46   20                                                      
CONECT   47   26                                                      
CONECT   48   27                                                      
MASTER        0    0    0    0    0    0    0    0   48    0   48    0
END
