COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      10.177  -1.966  -0.610  1.00  0.00           C  
HETATM    2  C   UNL     1       8.689  -1.641  -0.472  1.00  0.00           C  
HETATM    3  O   UNL     1       8.517  -0.226  -0.379  1.00  0.00           O  
HETATM    4  C   UNL     1       7.244   0.234  -0.251  1.00  0.00           C  
HETATM    5  C   UNL     1       6.178  -0.655  -0.208  1.00  0.00           C  
HETATM    6  N   UNL     1       4.942  -0.220  -0.084  1.00  0.00           N  
HETATM    7  C   UNL     1       6.996   1.601  -0.154  1.00  0.00           C  
HETATM    8  C   UNL     1       5.687   2.026  -0.025  1.00  0.00           C  
HETATM    9  C   UNL     1       4.665   1.076   0.004  1.00  0.00           C  
HETATM   10  C   UNL     1       3.260   1.517   0.142  1.00  0.00           C  
HETATM   11  N   UNL     1       2.153   0.710   0.191  1.00  0.00           N  
HETATM   12  C   UNL     1       2.122  -0.690   0.122  1.00  0.00           C  
HETATM   13  C   UNL     1       1.517  -1.320  -0.957  1.00  0.00           C  
HETATM   14  C   UNL     1       1.489  -2.700  -1.022  1.00  0.00           C  
HETATM   15  C   UNL     1       2.062  -3.453  -0.014  1.00  0.00           C  
HETATM   16  C   UNL     1       2.665  -2.828   1.062  1.00  0.00           C  
HETATM   17  C   UNL     1       2.702  -1.449   1.130  1.00  0.00           C  
HETATM   18  N   UNL     1       2.836   2.757   0.246  1.00  0.00           N  
HETATM   19  N   UNL     1       1.554   2.770   0.349  1.00  0.00           N  
HETATM   20  C   UNL     1       1.088   1.550   0.321  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.361   1.146   0.415  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.242   1.755  -0.688  1.00  0.00           C  
HETATM   23  C   UNL     1      -1.170   1.985   1.418  1.00  0.00           C  
HETATM   24  C   UNL     1      -2.317   1.959   0.392  1.00  0.00           C  
HETATM   25  N   UNL     1      -3.216   0.812   0.547  1.00  0.00           N  
HETATM   26  C   UNL     1      -4.488   0.890   0.108  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.890   1.910  -0.416  1.00  0.00           O  
HETATM   28  C   UNL     1      -5.396  -0.268   0.263  1.00  0.00           C  
HETATM   29  C   UNL     1      -6.740  -0.211  -0.191  1.00  0.00           C  
HETATM   30  N   UNL     1      -7.225   0.885  -0.771  1.00  0.00           N  
HETATM   31  C   UNL     1      -8.467   0.941  -1.192  1.00  0.00           C  
HETATM   32  C   UNL     1      -9.334  -0.140  -1.053  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.898  -1.294  -0.466  1.00  0.00           C  
HETATM   34  C   UNL     1      -7.563  -1.350  -0.015  1.00  0.00           C  
HETATM   35  N   UNL     1      -7.079  -2.448   0.565  1.00  0.00           N  
HETATM   36  C   UNL     1      -5.841  -2.516   0.990  1.00  0.00           C  
HETATM   37  C   UNL     1      -4.959  -1.446   0.853  1.00  0.00           C  
HETATM   38  H   UNL     1      10.714  -1.591   0.262  1.00  0.00           H  
HETATM   39  H   UNL     1      10.309  -3.046  -0.681  1.00  0.00           H  
HETATM   40  H   UNL     1      10.571  -1.492  -1.510  1.00  0.00           H  
HETATM   41  H   UNL     1       8.153  -2.016  -1.344  1.00  0.00           H  
HETATM   42  H   UNL     1       8.296  -2.115   0.428  1.00  0.00           H  
HETATM   43  H   UNL     1       6.365  -1.716  -0.278  1.00  0.00           H  
HETATM   44  H   UNL     1       7.808   2.313  -0.180  1.00  0.00           H  
HETATM   45  H   UNL     1       5.458   3.078   0.052  1.00  0.00           H  
HETATM   46  H   UNL     1       1.069  -0.733  -1.745  1.00  0.00           H  
HETATM   47  H   UNL     1       1.019  -3.191  -1.862  1.00  0.00           H  
HETATM   48  H   UNL     1       2.039  -4.531  -0.067  1.00  0.00           H  
HETATM   49  H   UNL     1       3.111  -3.419   1.848  1.00  0.00           H  
HETATM   50  H   UNL     1       3.177  -0.961   1.969  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.493   0.072   0.537  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.851   2.687  -1.096  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.528   1.042  -1.462  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.399   1.457   2.344  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.758   2.980   1.589  1.00  0.00           H  
HETATM   56  H   UNL     1      -2.850   2.906   0.308  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.896  -0.002   0.965  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.825   1.847  -1.658  1.00  0.00           H  
HETATM   59  H   UNL     1     -10.351  -0.066  -1.408  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.558  -2.141  -0.350  1.00  0.00           H  
HETATM   61  H   UNL     1      -5.494  -3.427   1.454  1.00  0.00           H  
HETATM   62  H   UNL     1      -3.943  -1.531   1.208  1.00  0.00           H  
CONECT    1    2   38   39   40                                       
CONECT    2    3    1   41   42                                       
CONECT    3    4    2                                                 
CONECT    4    5    3    7    7                                       
CONECT    5    6    6    4   43                                       
CONECT    6    5    5    9                                            
CONECT    7    4    4    8   44                                       
CONECT    8    9    9    7   45                                       
CONECT    9    6   10    8    8                                       
CONECT   10   18   18    9   11                                       
CONECT   11   10   20   12                                            
CONECT   12   11   13   13   17                                       
CONECT   13   12   12   14   46                                       
CONECT   14   13   15   15   47                                       
CONECT   15   14   14   16   48                                       
CONECT   16   17   17   15   49                                       
CONECT   17   12   16   16   50                                       
CONECT   18   19   10   10                                            
CONECT   19   18   20   20                                            
CONECT   20   19   19   11   21                                       
CONECT   21   23   20   22   51                                       
CONECT   22   24   21   52   53                                       
CONECT   23   24   21   54   55                                       
CONECT   24   23   25   22   56                                       
CONECT   25   24   26   57                                            
CONECT   26   27   27   25   28                                       
CONECT   27   26   26                                                 
CONECT   28   26   37   37   29                                       
CONECT   29   28   30   30   34                                       
CONECT   30   29   29   31                                            
CONECT   31   30   32   32   58                                       
CONECT   32   31   31   33   59                                       
CONECT   33   34   34   32   60                                       
CONECT   34   29   35   33   33                                       
CONECT   35   36   36   34                                            
CONECT   36   37   35   35   61                                       
CONECT   37   28   28   36   62                                       
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    2                                                      
CONECT   42    2                                                      
CONECT   43    5                                                      
CONECT   44    7                                                      
CONECT   45    8                                                      
CONECT   46   13                                                      
CONECT   47   14                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   21                                                      
CONECT   52   22                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   24                                                      
CONECT   57   25                                                      
CONECT   58   31                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   36                                                      
CONECT   62   37                                                      
MASTER        0    0    0    0    0    0    0    0   62    0   62    0
END
