COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.593   1.526   0.216  1.00  0.00           N  
HETATM    2  C   UNL     1      -4.991  -1.153   0.272  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.978  -0.245   0.213  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.286   1.122   0.184  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.500   2.285   0.125  1.00  0.00           C  
HETATM    6  C   UNL     1      -4.377   3.373   0.123  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.025   2.346   0.075  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.365   3.581   0.023  1.00  0.00           C  
HETATM    9  C   UNL     1       2.136   0.131  -0.121  1.00  0.00           C  
HETATM   10  C   UNL     1       4.883   0.181  -0.468  1.00  0.00           C  
HETATM   11  C   UNL     1       4.076   1.040  -1.200  1.00  0.00           C  
HETATM   12  C   UNL     1       2.706   1.015  -1.027  1.00  0.00           C  
HETATM   13  C   UNL     1       7.001  -0.706   0.148  1.00  0.00           C  
HETATM   14  N   UNL     1      -6.613   0.568   0.277  1.00  0.00           N  
HETATM   15  C   UNL     1      -6.326  -0.713   0.304  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.610   2.924   0.171  1.00  0.00           N  
HETATM   17  N   UNL     1      -1.300   1.227   0.083  1.00  0.00           N  
HETATM   18  C   UNL     1       0.022   1.282   0.039  1.00  0.00           C  
HETATM   19  N   UNL     1       0.670   2.436  -0.015  1.00  0.00           N  
HETATM   20  C   UNL     1       0.015   3.588  -0.022  1.00  0.00           C  
HETATM   21  N   UNL     1       0.746   0.101   0.050  1.00  0.00           N  
HETATM   22  C   UNL     1       2.944  -0.729   0.611  1.00  0.00           C  
HETATM   23  C   UNL     1       4.314  -0.703   0.437  1.00  0.00           C  
HETATM   24  O   UNL     1       6.231   0.205  -0.638  1.00  0.00           O  
HETATM   25  C   UNL     1       8.486  -0.534  -0.179  1.00  0.00           C  
HETATM   26  O   UNL     1       8.914   0.768   0.224  1.00  0.00           O  
HETATM   27  C   UNL     1       9.299  -1.592   0.568  1.00  0.00           C  
HETATM   28  N   UNL     1      10.716  -1.474   0.197  1.00  0.00           N  
HETATM   29  C   UNL     1      11.575  -2.145   1.181  1.00  0.00           C  
HETATM   30  C   UNL     1      10.952  -2.001  -1.154  1.00  0.00           C  
HETATM   31  N   UNL     1      -7.356  -1.647   0.364  1.00  0.00           N  
HETATM   32  C   UNL     1      -7.069  -3.081   0.522  1.00  0.00           C  
HETATM   33  C   UNL     1      -7.842  -3.851  -0.555  1.00  0.00           C  
HETATM   34  O   UNL     1      -9.219  -3.469  -0.509  1.00  0.00           O  
HETATM   35  C   UNL     1      -9.454  -2.088  -0.794  1.00  0.00           C  
HETATM   36  C   UNL     1      -8.764  -1.228   0.276  1.00  0.00           C  
HETATM   37  H   UNL     1      -4.770  -2.210   0.294  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.950  -0.575   0.188  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.089   4.413   0.084  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.923   4.506   0.019  1.00  0.00           H  
HETATM   41  H   UNL     1       4.519   1.728  -1.904  1.00  0.00           H  
HETATM   42  H   UNL     1       2.078   1.684  -1.597  1.00  0.00           H  
HETATM   43  H   UNL     1       6.836  -0.503   1.206  1.00  0.00           H  
HETATM   44  H   UNL     1       6.696  -1.728  -0.078  1.00  0.00           H  
HETATM   45  H   UNL     1       0.555   4.522  -0.062  1.00  0.00           H  
HETATM   46  H   UNL     1       0.291  -0.746   0.176  1.00  0.00           H  
HETATM   47  H   UNL     1       2.502  -1.417   1.316  1.00  0.00           H  
HETATM   48  H   UNL     1       4.943  -1.372   1.006  1.00  0.00           H  
HETATM   49  H   UNL     1       8.638  -0.650  -1.252  1.00  0.00           H  
HETATM   50  H   UNL     1       8.808   0.942   1.170  1.00  0.00           H  
HETATM   51  H   UNL     1       9.191  -1.442   1.642  1.00  0.00           H  
HETATM   52  H   UNL     1       8.936  -2.585   0.302  1.00  0.00           H  
HETATM   53  H   UNL     1      11.373  -3.216   1.171  1.00  0.00           H  
HETATM   54  H   UNL     1      12.621  -1.970   0.929  1.00  0.00           H  
HETATM   55  H   UNL     1      11.370  -1.746   2.175  1.00  0.00           H  
HETATM   56  H   UNL     1      10.354  -1.440  -1.872  1.00  0.00           H  
HETATM   57  H   UNL     1      12.008  -1.901  -1.403  1.00  0.00           H  
HETATM   58  H   UNL     1      10.668  -3.053  -1.188  1.00  0.00           H  
HETATM   59  H   UNL     1      -6.000  -3.258   0.403  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.389  -3.412   1.510  1.00  0.00           H  
HETATM   61  H   UNL     1      -7.432  -3.614  -1.537  1.00  0.00           H  
HETATM   62  H   UNL     1      -7.755  -4.922  -0.371  1.00  0.00           H  
HETATM   63  H   UNL     1      -9.049  -1.845  -1.777  1.00  0.00           H  
HETATM   64  H   UNL     1     -10.526  -1.891  -0.783  1.00  0.00           H  
HETATM   65  H   UNL     1      -9.251  -1.376   1.240  1.00  0.00           H  
HETATM   66  H   UNL     1      -8.817  -0.176  -0.005  1.00  0.00           H  
CONECT    1   16    4   14                                            
CONECT    2    3    3   15   37                                       
CONECT    3    2    2    4   38                                       
CONECT    4    1    3    5    5                                       
CONECT    5    4    4    7    6                                       
CONECT    6    5   16   16   39                                       
CONECT    7    5    8    8   17                                       
CONECT    8    7    7   20   40                                       
CONECT    9   21   12   12   22                                       
CONECT   10   11   11   23   24                                       
CONECT   11   10   10   12   41                                       
CONECT   12    9    9   11   42                                       
CONECT   13   24   25   43   44                                       
CONECT   14    1   15   15                                            
CONECT   15    2   14   14   31                                       
CONECT   16    1    6    6                                            
CONECT   17    7   18   18                                            
CONECT   18   17   17   19   21                                       
CONECT   19   18   20   20                                            
CONECT   20    8   19   19   45                                       
CONECT   21    9   18   46                                            
CONECT   22    9   23   23   47                                       
CONECT   23   10   22   22   48                                       
CONECT   24   10   13                                                 
CONECT   25   13   26   27   49                                       
CONECT   26   25   50                                                 
CONECT   27   25   28   51   52                                       
CONECT   28   27   30   29                                            
CONECT   29   28   53   54   55                                       
CONECT   30   28   56   57   58                                       
CONECT   31   15   36   32                                            
CONECT   32   31   33   59   60                                       
CONECT   33   32   34   61   62                                       
CONECT   34   33   35                                                 
CONECT   35   34   36   63   64                                       
CONECT   36   31   35   65   66                                       
CONECT   37    2                                                      
CONECT   38    3                                                      
CONECT   39    6                                                      
CONECT   40    8                                                      
CONECT   41   11                                                      
CONECT   42   12                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   23                                                      
CONECT   49   25                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   29                                                      
CONECT   56   30                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   32                                                      
CONECT   60   32                                                      
CONECT   61   33                                                      
CONECT   62   33                                                      
CONECT   63   35                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   36                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
