COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       3.936  -0.387   0.802  1.00  0.00           O  
HETATM    2  C   UNL     1       3.592  -0.913  -0.238  1.00  0.00           C  
HETATM    3  O   UNL     1       4.499  -1.547  -1.004  1.00  0.00           O  
HETATM    4  C   UNL     1       5.870  -1.563  -0.527  1.00  0.00           C  
HETATM    5  C   UNL     1       5.927  -2.256   0.836  1.00  0.00           C  
HETATM    6  C   UNL     1       6.748  -2.323  -1.523  1.00  0.00           C  
HETATM    7  C   UNL     1       6.379  -0.126  -0.390  1.00  0.00           C  
HETATM    8  N   UNL     1       2.300  -0.867  -0.621  1.00  0.00           N  
HETATM    9  C   UNL     1       1.312  -0.182   0.217  1.00  0.00           C  
HETATM   10  C   UNL     1       1.311   1.312  -0.113  1.00  0.00           C  
HETATM   11  C   UNL     1       2.640   1.911   0.268  1.00  0.00           C  
HETATM   12  C   UNL     1       3.672   1.945  -0.651  1.00  0.00           C  
HETATM   13  C   UNL     1       4.892   2.494  -0.302  1.00  0.00           C  
HETATM   14  C   UNL     1       5.079   3.011   0.967  1.00  0.00           C  
HETATM   15  C   UNL     1       4.046   2.978   1.885  1.00  0.00           C  
HETATM   16  C   UNL     1       2.826   2.433   1.535  1.00  0.00           C  
HETATM   17  C   UNL     1      -0.056  -0.756  -0.050  1.00  0.00           C  
HETATM   18  O   UNL     1      -0.192  -1.649  -0.859  1.00  0.00           O  
HETATM   19  N   UNL     1      -1.128  -0.277   0.612  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.471  -0.757   0.276  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.797  -1.991   1.121  1.00  0.00           C  
HETATM   22  C   UNL     1      -4.157  -2.551   0.701  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.586  -3.697   1.646  1.00  0.00           C  
HETATM   24  C   UNL     1      -5.291  -4.664   0.669  1.00  0.00           C  
HETATM   25  N   UNL     1      -4.701  -4.390  -0.646  1.00  0.00           N  
HETATM   26  C   UNL     1      -4.063  -3.207  -0.659  1.00  0.00           C  
HETATM   27  O   UNL     1      -3.496  -2.734  -1.621  1.00  0.00           O  
HETATM   28  C   UNL     1      -3.493   0.343   0.565  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.243   1.530  -0.369  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.250   2.614  -0.084  1.00  0.00           C  
HETATM   31  O   UNL     1      -5.083   2.454   0.776  1.00  0.00           O  
HETATM   32  O   UNL     1      -4.222   3.757  -0.787  1.00  0.00           O  
HETATM   33  C   UNL     1      -5.222   4.757  -0.460  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.034   5.981  -1.358  1.00  0.00           C  
HETATM   35  H   UNL     1       2.025  -1.286  -1.451  1.00  0.00           H  
HETATM   36  H   UNL     1       5.565  -3.279   0.739  1.00  0.00           H  
HETATM   37  H   UNL     1       6.956  -2.267   1.195  1.00  0.00           H  
HETATM   38  H   UNL     1       5.301  -1.714   1.546  1.00  0.00           H  
HETATM   39  H   UNL     1       6.707  -1.829  -2.494  1.00  0.00           H  
HETATM   40  H   UNL     1       7.777  -2.334  -1.164  1.00  0.00           H  
HETATM   41  H   UNL     1       6.385  -3.346  -1.620  1.00  0.00           H  
HETATM   42  H   UNL     1       5.753   0.415   0.319  1.00  0.00           H  
HETATM   43  H   UNL     1       7.408  -0.138  -0.032  1.00  0.00           H  
HETATM   44  H   UNL     1       6.338   0.367  -1.361  1.00  0.00           H  
HETATM   45  H   UNL     1       1.566  -0.322   1.267  1.00  0.00           H  
HETATM   46  H   UNL     1       1.144   1.448  -1.182  1.00  0.00           H  
HETATM   47  H   UNL     1       0.516   1.807   0.444  1.00  0.00           H  
HETATM   48  H   UNL     1       3.526   1.541  -1.642  1.00  0.00           H  
HETATM   49  H   UNL     1       2.018   2.410   2.251  1.00  0.00           H  
HETATM   50  H   UNL     1       5.698   2.520  -1.019  1.00  0.00           H  
HETATM   51  H   UNL     1       6.031   3.440   1.240  1.00  0.00           H  
HETATM   52  H   UNL     1       4.193   3.382   2.877  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.011   0.386   1.310  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.509  -1.020  -0.781  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.029  -2.749   0.968  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.828  -1.712   2.174  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.499  -0.043   0.400  1.00  0.00           H  
HETATM   58  H   UNL     1      -3.394   0.669   1.600  1.00  0.00           H  
HETATM   59  H   UNL     1      -4.909  -1.761   0.694  1.00  0.00           H  
HETATM   60  H   UNL     1      -3.717  -4.170   2.105  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.279  -3.337   2.407  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.101  -5.698   0.960  1.00  0.00           H  
HETATM   63  H   UNL     1      -6.362  -4.467   0.651  1.00  0.00           H  
HETATM   64  H   UNL     1      -4.764  -4.986  -1.409  1.00  0.00           H  
HETATM   65  H   UNL     1      -2.237   1.916  -0.203  1.00  0.00           H  
HETATM   66  H   UNL     1      -3.342   1.204  -1.404  1.00  0.00           H  
HETATM   67  H   UNL     1      -6.217   4.341  -0.617  1.00  0.00           H  
HETATM   68  H   UNL     1      -5.113   5.052   0.584  1.00  0.00           H  
HETATM   69  H   UNL     1      -4.038   6.397  -1.201  1.00  0.00           H  
HETATM   70  H   UNL     1      -5.143   5.686  -2.402  1.00  0.00           H  
HETATM   71  H   UNL     1      -5.785   6.732  -1.112  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    3    8                                       
CONECT    3    2    4                                                 
CONECT    4    3    5    6    7                                       
CONECT    5    4   36   37   38                                       
CONECT    6    4   39   40   41                                       
CONECT    7    4   42   43   44                                       
CONECT    8    2    9   35                                            
CONECT    9    8   10   17   45                                       
CONECT   10    9   11   46   47                                       
CONECT   11   10   12   16   16                                       
CONECT   12   11   13   13   48                                       
CONECT   13   12   12   14   50                                       
CONECT   14   13   15   15   51                                       
CONECT   15   14   14   16   52                                       
CONECT   16   11   11   15   49                                       
CONECT   17    9   18   18   19                                       
CONECT   18   17   17                                                 
CONECT   19   17   20   53                                            
CONECT   20   19   21   28   54                                       
CONECT   21   20   22   55   56                                       
CONECT   22   21   23   26   59                                       
CONECT   23   22   24   60   61                                       
CONECT   24   23   25   62   63                                       
CONECT   25   24   26   64                                            
CONECT   26   22   25   27   27                                       
CONECT   27   26   26                                                 
CONECT   28   20   29   57   58                                       
CONECT   29   28   30   65   66                                       
CONECT   30   29   31   31   32                                       
CONECT   31   30   30                                                 
CONECT   32   30   33                                                 
CONECT   33   32   34   67   68                                       
CONECT   34   33   69   70   71                                       
CONECT   35    8                                                      
CONECT   36    5                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    6                                                      
CONECT   42    7                                                      
CONECT   43    7                                                      
CONECT   44    7                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   12                                                      
CONECT   49   16                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   15                                                      
CONECT   53   19                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   28                                                      
CONECT   58   28                                                      
CONECT   59   22                                                      
CONECT   60   23                                                      
CONECT   61   23                                                      
CONECT   62   24                                                      
CONECT   63   24                                                      
CONECT   64   25                                                      
CONECT   65   29                                                      
CONECT   66   29                                                      
CONECT   67   33                                                      
CONECT   68   33                                                      
CONECT   69   34                                                      
CONECT   70   34                                                      
CONECT   71   34                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
