COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.605  -1.276  -0.265  1.00  0.00           C  
HETATM    2  C   UNL     1      -6.006  -0.814   0.045  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.507  -0.884   1.336  1.00  0.00           C  
HETATM    4  N   UNL     1      -0.035   0.378  -0.486  1.00  0.00           N  
HETATM    5  C   UNL     1      -7.796  -0.451   1.582  1.00  0.00           C  
HETATM    6  C   UNL     1      -8.100   0.111  -0.631  1.00  0.00           C  
HETATM    7  N   UNL     1      -3.675  -0.155  -0.105  1.00  0.00           N  
HETATM    8  C   UNL     1      -6.822  -0.303  -0.953  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.763   1.946  -1.155  1.00  0.00           C  
HETATM   10  C   UNL     1      -0.376   2.469  -1.607  1.00  0.00           C  
HETATM   11  C   UNL     1       0.457   1.163  -1.633  1.00  0.00           C  
HETATM   12  N   UNL     1      -8.546   0.024   0.607  1.00  0.00           N  
HETATM   13  C   UNL     1       3.080  -0.520   0.678  1.00  0.00           C  
HETATM   14  C   UNL     1       3.122   0.987   0.699  1.00  0.00           C  
HETATM   15  C   UNL     1       3.005   1.664   1.898  1.00  0.00           C  
HETATM   16  N   UNL     1       2.080  -2.449  -0.451  1.00  0.00           N  
HETATM   17  C   UNL     1       2.021  -0.987  -0.323  1.00  0.00           C  
HETATM   18  O   UNL     1      -1.944  -1.424  -0.667  1.00  0.00           O  
HETATM   19  C   UNL     1       0.655  -0.579   0.165  1.00  0.00           C  
HETATM   20  C   UNL     1       3.043   3.046   1.918  1.00  0.00           C  
HETATM   21  C   UNL     1       3.197   3.750   0.738  1.00  0.00           C  
HETATM   22  C   UNL     1       3.314   3.072  -0.461  1.00  0.00           C  
HETATM   23  C   UNL     1       3.283   1.690  -0.480  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.401   0.817  -0.166  1.00  0.00           C  
HETATM   25  C   UNL     1       4.429  -1.054   0.268  1.00  0.00           C  
HETATM   26  C   UNL     1       5.227  -1.700   1.193  1.00  0.00           C  
HETATM   27  C   UNL     1       6.463  -2.190   0.817  1.00  0.00           C  
HETATM   28  C   UNL     1       6.903  -2.033  -0.484  1.00  0.00           C  
HETATM   29  C   UNL     1       6.105  -1.386  -1.409  1.00  0.00           C  
HETATM   30  C   UNL     1       4.865  -0.902  -1.035  1.00  0.00           C  
HETATM   31  C   UNL     1      -2.358  -0.335  -0.331  1.00  0.00           C  
HETATM   32  O   UNL     1       0.176  -1.112   1.143  1.00  0.00           O  
HETATM   33  H   UNL     1      -4.328  -2.079   0.418  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.562  -1.640  -1.291  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.898  -1.273   2.138  1.00  0.00           H  
HETATM   36  H   UNL     1      -8.194  -0.503   2.585  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.744   0.506  -1.403  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.006   0.716   0.164  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.462  -0.228  -1.969  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.327   2.732  -0.652  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.322   1.551  -2.003  1.00  0.00           H  
HETATM   42  H   UNL     1      -0.431   2.915  -2.600  1.00  0.00           H  
HETATM   43  H   UNL     1       0.030   3.176  -0.884  1.00  0.00           H  
HETATM   44  H   UNL     1       1.517   1.386  -1.513  1.00  0.00           H  
HETATM   45  H   UNL     1       0.286   0.622  -2.564  1.00  0.00           H  
HETATM   46  H   UNL     1       2.830  -0.891   1.672  1.00  0.00           H  
HETATM   47  H   UNL     1       2.884   1.114   2.820  1.00  0.00           H  
HETATM   48  H   UNL     1       2.964  -2.743  -0.837  1.00  0.00           H  
HETATM   49  H   UNL     1       1.906  -2.897   0.437  1.00  0.00           H  
HETATM   50  H   UNL     1       2.212  -0.529  -1.294  1.00  0.00           H  
HETATM   51  H   UNL     1       2.951   3.576   2.855  1.00  0.00           H  
HETATM   52  H   UNL     1       3.222   4.830   0.753  1.00  0.00           H  
HETATM   53  H   UNL     1       3.435   3.622  -1.383  1.00  0.00           H  
HETATM   54  H   UNL     1       3.374   1.161  -1.417  1.00  0.00           H  
HETATM   55  H   UNL     1      -1.445   1.192   0.856  1.00  0.00           H  
HETATM   56  H   UNL     1       4.884  -1.823   2.210  1.00  0.00           H  
HETATM   57  H   UNL     1       7.087  -2.695   1.540  1.00  0.00           H  
HETATM   58  H   UNL     1       7.869  -2.415  -0.778  1.00  0.00           H  
HETATM   59  H   UNL     1       6.448  -1.263  -2.426  1.00  0.00           H  
HETATM   60  H   UNL     1       4.240  -0.400  -1.759  1.00  0.00           H  
CONECT    1    7    2   33   34                                       
CONECT    2    1    8    8    3                                       
CONECT    3    2    5    5   35                                       
CONECT    4   24   11   19                                            
CONECT    5    3    3   12   36                                       
CONECT    6    8   12   12   37                                       
CONECT    7   31    1   38                                            
CONECT    8    2    2    6   39                                       
CONECT    9   10   24   40   41                                       
CONECT   10    9   11   42   43                                       
CONECT   11   10    4   44   45                                       
CONECT   12    6    6    5                                            
CONECT   13   14   17   25   46                                       
CONECT   14   23   23   15   13                                       
CONECT   15   20   20   14   47                                       
CONECT   16   17   48   49                                            
CONECT   17   19   13   16   50                                       
CONECT   18   31   31                                                 
CONECT   19    4   32   32   17                                       
CONECT   20   21   15   15   51                                       
CONECT   21   22   22   20   52                                       
CONECT   22   21   21   23   53                                       
CONECT   23   22   14   14   54                                       
CONECT   24    9   31    4   55                                       
CONECT   25   13   30   30   26                                       
CONECT   26   25   27   27   56                                       
CONECT   27   26   26   28   57                                       
CONECT   28   29   29   27   58                                       
CONECT   29   30   28   28   59                                       
CONECT   30   25   25   29   60                                       
CONECT   31   24   18   18    7                                       
CONECT   32   19   19                                                 
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    3                                                      
CONECT   36    5                                                      
CONECT   37    6                                                      
CONECT   38    7                                                      
CONECT   39    8                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   10                                                      
CONECT   44   11                                                      
CONECT   45   11                                                      
CONECT   46   13                                                      
CONECT   47   15                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   24                                                      
CONECT   56   26                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
CONECT   60   30                                                      
MASTER        0    0    0    0    0    0    0    0   60    0   60    0
END
