COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       4.271   2.250   1.473  1.00  0.00           N  
HETATM    2  C   UNL     1       3.202   1.762  -0.565  1.00  0.00           C  
HETATM    3  O   UNL     1      -0.377   1.062  -1.564  1.00  0.00           O  
HETATM    4  C   UNL     1       3.435   1.482   0.765  1.00  0.00           C  
HETATM    5  C   UNL     1       3.228  -3.204   1.089  1.00  0.00           C  
HETATM    6  C   UNL     1       3.398  -1.924   1.590  1.00  0.00           C  
HETATM    7  C   UNL     1       1.795  -2.355  -0.640  1.00  0.00           C  
HETATM    8  C   UNL     1       2.423  -3.418  -0.015  1.00  0.00           C  
HETATM    9  C   UNL     1       0.111   0.210  -0.847  1.00  0.00           C  
HETATM   10  C   UNL     1       2.229  -4.817  -0.540  1.00  0.00           C  
HETATM   11  C   UNL     1       0.917  -2.592  -1.842  1.00  0.00           C  
HETATM   12  C   UNL     1      -2.050  -0.271   0.024  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.777  -0.719   1.119  1.00  0.00           C  
HETATM   14  C   UNL     1       4.895   3.285   0.960  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.124  -0.430   1.217  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.749   0.304   0.226  1.00  0.00           C  
HETATM   17  C   UNL     1      -4.028   0.751  -0.866  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.681   0.466  -0.970  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.219   0.617   0.335  1.00  0.00           C  
HETATM   20  C   UNL     1      -6.476   1.423   1.610  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.659   1.434  -0.881  1.00  0.00           C  
HETATM   22  C   UNL     1      -7.016  -0.688   0.388  1.00  0.00           C  
HETATM   23  C   UNL     1       4.705   3.625  -0.365  1.00  0.00           C  
HETATM   24  C   UNL     1       3.852   2.858  -1.137  1.00  0.00           C  
HETATM   25  C   UNL     1       2.302   0.993  -1.494  1.00  0.00           C  
HETATM   26  C   UNL     1       2.756  -0.863   0.976  1.00  0.00           C  
HETATM   27  C   UNL     1       1.979  -1.069  -0.153  1.00  0.00           C  
HETATM   28  N   UNL     1      -0.684  -0.557  -0.075  1.00  0.00           N  
HETATM   29  N   UNL     1       1.447   0.034  -0.823  1.00  0.00           N  
HETATM   30  N   UNL     1       2.854   0.438   1.464  1.00  0.00           N  
HETATM   31  H   UNL     1       3.727  -4.038   1.561  1.00  0.00           H  
HETATM   32  H   UNL     1       4.025  -1.756   2.454  1.00  0.00           H  
HETATM   33  H   UNL     1       2.996  -5.036  -1.283  1.00  0.00           H  
HETATM   34  H   UNL     1       2.306  -5.528   0.282  1.00  0.00           H  
HETATM   35  H   UNL     1       1.244  -4.898  -1.000  1.00  0.00           H  
HETATM   36  H   UNL     1       1.518  -2.532  -2.749  1.00  0.00           H  
HETATM   37  H   UNL     1       0.464  -3.581  -1.771  1.00  0.00           H  
HETATM   38  H   UNL     1       0.133  -1.835  -1.874  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.290  -1.293   1.893  1.00  0.00           H  
HETATM   40  H   UNL     1       5.559   3.873   1.576  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.690  -0.779   2.069  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.519   1.323  -1.639  1.00  0.00           H  
HETATM   43  H   UNL     1      -2.118   0.815  -1.823  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.908   2.352   1.573  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.539   1.649   1.690  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.162   0.840   2.477  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.477   0.859  -1.790  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.722   1.660  -0.802  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.091   2.363  -0.919  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.703  -1.270   1.255  1.00  0.00           H  
HETATM   51  H   UNL     1      -8.079  -0.462   0.468  1.00  0.00           H  
HETATM   52  H   UNL     1      -6.834  -1.263  -0.520  1.00  0.00           H  
HETATM   53  H   UNL     1       5.215   4.477  -0.792  1.00  0.00           H  
HETATM   54  H   UNL     1       3.688   3.105  -2.175  1.00  0.00           H  
HETATM   55  H   UNL     1       1.673   1.700  -2.034  1.00  0.00           H  
HETATM   56  H   UNL     1       2.921   0.461  -2.216  1.00  0.00           H  
HETATM   57  H   UNL     1      -0.309  -1.308   0.412  1.00  0.00           H  
HETATM   58  H   UNL     1       2.494   0.623   2.345  1.00  0.00           H  
CONECT    1   14   14    4                                            
CONECT    2   24   25    4    4                                       
CONECT    3    9    9                                                 
CONECT    4    2    2    1   30                                       
CONECT    5    8    8    6   31                                       
CONECT    6   26   26    5   32                                       
CONECT    7   11   27   27    8                                       
CONECT    8    7   10    5    5                                       
CONECT    9    3    3   29   28                                       
CONECT   10    8   33   34   35                                       
CONECT   11    7   36   37   38                                       
CONECT   12   18   28   13   13                                       
CONECT   13   12   12   15   39                                       
CONECT   14   23    1    1   40                                       
CONECT   15   16   16   13   41                                       
CONECT   16   17   19   15   15                                       
CONECT   17   18   18   16   42                                       
CONECT   18   17   17   12   43                                       
CONECT   19   21   16   20   22                                       
CONECT   20   19   44   45   46                                       
CONECT   21   19   47   48   49                                       
CONECT   22   19   50   51   52                                       
CONECT   23   24   24   14   53                                       
CONECT   24   23   23    2   54                                       
CONECT   25    2   29   55   56                                       
CONECT   26   27   30    6    6                                       
CONECT   27   29    7    7   26                                       
CONECT   28    9   12   57                                            
CONECT   29   25    9   27                                            
CONECT   30    4   26   58                                            
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33   10                                                      
CONECT   34   10                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   11                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   17                                                      
CONECT   43   18                                                      
CONECT   44   20                                                      
CONECT   45   20                                                      
CONECT   46   20                                                      
CONECT   47   21                                                      
CONECT   48   21                                                      
CONECT   49   21                                                      
CONECT   50   22                                                      
CONECT   51   22                                                      
CONECT   52   22                                                      
CONECT   53   23                                                      
CONECT   54   24                                                      
CONECT   55   25                                                      
CONECT   56   25                                                      
CONECT   57   28                                                      
CONECT   58   30                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
