COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.459  -1.142  -1.562  1.00  0.00           C  
HETATM    2  C   UNL     1       4.214  -2.606  -1.312  1.00  0.00           C  
HETATM    3  C   UNL     1       3.367  -1.334  -1.429  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.896  -1.079  -0.307  1.00  0.00           C  
HETATM    5  C   UNL     1       3.228  -1.111   0.982  1.00  0.00           C  
HETATM    6  C   UNL     1       4.069  -2.374   1.197  1.00  0.00           C  
HETATM    7  C   UNL     1       1.576  -0.191  -0.418  1.00  0.00           C  
HETATM    8  C   UNL     1       1.160   2.062  -0.649  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.714  -1.235   0.833  1.00  0.00           C  
HETATM   10  N   UNL     1      -2.527  -0.864  -0.164  1.00  0.00           N  
HETATM   11  C   UNL     1       0.200  -0.433  -0.465  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.305  -1.846  -0.350  1.00  0.00           C  
HETATM   13  C   UNL     1      -1.754  -1.921  -0.835  1.00  0.00           C  
HETATM   14  C   UNL     1      -0.653   0.634  -0.611  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.831  -1.353  -1.718  1.00  0.00           C  
HETATM   16  C   UNL     1      -6.651  -1.502  -0.623  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.104  -1.454   0.670  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.146   0.455  -0.682  1.00  0.00           C  
HETATM   19  N   UNL     1      -0.145   1.860  -0.697  1.00  0.00           N  
HETATM   20  N   UNL     1       2.014   1.060  -0.512  1.00  0.00           N  
HETATM   21  N   UNL     1       2.470  -1.239  -0.269  1.00  0.00           N  
HETATM   22  N   UNL     1       4.886  -2.601  -0.004  1.00  0.00           N  
HETATM   23  C   UNL     1       6.216  -2.801   0.091  1.00  0.00           C  
HETATM   24  C   UNL     1       6.885  -2.792   1.441  1.00  0.00           C  
HETATM   25  O   UNL     1       6.874  -2.988  -0.910  1.00  0.00           O  
HETATM   26  C   UNL     1       8.384  -3.041   1.270  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.916  -1.603   1.809  1.00  0.00           C  
HETATM   28  C   UNL     1      -6.355  -1.551   3.048  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.985  -1.352   3.206  1.00  0.00           C  
HETATM   30  C   UNL     1      -4.173  -1.176   2.127  1.00  0.00           C  
HETATM   31  O   UNL     1      -6.363  -1.411  -2.967  1.00  0.00           O  
HETATM   32  O   UNL     1       1.636   3.326  -0.740  1.00  0.00           O  
HETATM   33  C   UNL     1       0.674   4.373  -0.886  1.00  0.00           C  
HETATM   34  C   UNL     1       1.214   5.655  -0.251  1.00  0.00           C  
HETATM   35  N   UNL     1       1.473   5.423   1.176  1.00  0.00           N  
HETATM   36  C   UNL     1       2.211   6.548   1.767  1.00  0.00           C  
HETATM   37  C   UNL     1       0.222   5.173   1.905  1.00  0.00           C  
HETATM   38  C   UNL     1       0.404   4.614  -2.373  1.00  0.00           C  
HETATM   39  H   UNL     1      -3.835  -1.023  -2.435  1.00  0.00           H  
HETATM   40  H   UNL     1       3.571  -3.483  -1.390  1.00  0.00           H  
HETATM   41  H   UNL     1       4.959  -2.624  -2.107  1.00  0.00           H  
HETATM   42  H   UNL     1       4.022  -0.463  -1.455  1.00  0.00           H  
HETATM   43  H   UNL     1       2.777  -1.373  -2.344  1.00  0.00           H  
HETATM   44  H   UNL     1       2.537  -0.988   1.816  1.00  0.00           H  
HETATM   45  H   UNL     1       3.885  -0.242   0.923  1.00  0.00           H  
HETATM   46  H   UNL     1       4.720  -2.237   2.062  1.00  0.00           H  
HETATM   47  H   UNL     1       3.412  -3.227   1.364  1.00  0.00           H  
HETATM   48  H   UNL     1       0.315  -2.503  -0.960  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.255  -2.165   0.691  1.00  0.00           H  
HETATM   50  H   UNL     1      -2.173  -2.895  -0.585  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.787  -1.770  -1.914  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.710  -1.664  -0.757  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.471   0.543  -1.718  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.631   1.229  -0.088  1.00  0.00           H  
HETATM   55  H   UNL     1       6.729  -1.824   1.918  1.00  0.00           H  
HETATM   56  H   UNL     1       6.455  -3.577   2.065  1.00  0.00           H  
HETATM   57  H   UNL     1       8.868  -3.034   2.246  1.00  0.00           H  
HETATM   58  H   UNL     1       8.540  -4.009   0.793  1.00  0.00           H  
HETATM   59  H   UNL     1       8.814  -2.256   0.646  1.00  0.00           H  
HETATM   60  H   UNL     1      -7.979  -1.757   1.701  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.980  -1.665   3.920  1.00  0.00           H  
HETATM   62  H   UNL     1      -4.564  -1.314   4.200  1.00  0.00           H  
HETATM   63  H   UNL     1      -3.115  -1.010   2.266  1.00  0.00           H  
HETATM   64  H   UNL     1      -6.381  -2.301  -3.346  1.00  0.00           H  
HETATM   65  H   UNL     1      -0.254   4.085  -0.391  1.00  0.00           H  
HETATM   66  H   UNL     1       2.142   5.943  -0.746  1.00  0.00           H  
HETATM   67  H   UNL     1       0.480   6.453  -0.362  1.00  0.00           H  
HETATM   68  H   UNL     1       1.625   7.462   1.662  1.00  0.00           H  
HETATM   69  H   UNL     1       2.389   6.351   2.824  1.00  0.00           H  
HETATM   70  H   UNL     1       3.165   6.667   1.254  1.00  0.00           H  
HETATM   71  H   UNL     1      -0.269   4.293   1.491  1.00  0.00           H  
HETATM   72  H   UNL     1       0.443   5.005   2.958  1.00  0.00           H  
HETATM   73  H   UNL     1      -0.435   6.037   1.804  1.00  0.00           H  
HETATM   74  H   UNL     1      -0.330   5.412  -2.484  1.00  0.00           H  
HETATM   75  H   UNL     1       1.331   4.902  -2.868  1.00  0.00           H  
HETATM   76  H   UNL     1       0.019   3.700  -2.825  1.00  0.00           H  
CONECT    1   15   15    4   39                                       
CONECT    2    3   22   40   41                                       
CONECT    3   21    2   42   43                                       
CONECT    4    1   10    9    9                                       
CONECT    5   21    6   44   45                                       
CONECT    6    5   22   46   47                                       
CONECT    7   11   21   20   20                                       
CONECT    8   19   19   20   32                                       
CONECT    9    4    4   17   30                                       
CONECT   10   13    4   18                                            
CONECT   11   12   14   14    7                                       
CONECT   12   13   11   48   49                                       
CONECT   13   10   12   50   51                                       
CONECT   14   18   11   11   19                                       
CONECT   15   31    1    1   16                                       
CONECT   16   15   17   17   52                                       
CONECT   17   16   16    9   27                                       
CONECT   18   10   14   53   54                                       
CONECT   19   14    8    8                                            
CONECT   20    7    7    8                                            
CONECT   21    7    3    5                                            
CONECT   22    2    6   23                                            
CONECT   23   24   22   25   25                                       
CONECT   24   23   26   55   56                                       
CONECT   25   23   23                                                 
CONECT   26   24   57   58   59                                       
CONECT   27   17   28   28   60                                       
CONECT   28   27   27   29   61                                       
CONECT   29   30   30   28   62                                       
CONECT   30    9   29   29   63                                       
CONECT   31   15   64                                                 
CONECT   32    8   33                                                 
CONECT   33   32   34   38   65                                       
CONECT   34   35   33   66   67                                       
CONECT   35   36   37   34                                            
CONECT   36   35   68   69   70                                       
CONECT   37   35   71   72   73                                       
CONECT   38   33   74   75   76                                       
CONECT   39    1                                                      
CONECT   40    2                                                      
CONECT   41    2                                                      
CONECT   42    3                                                      
CONECT   43    3                                                      
CONECT   44    5                                                      
CONECT   45    5                                                      
CONECT   46    6                                                      
CONECT   47    6                                                      
CONECT   48   12                                                      
CONECT   49   12                                                      
CONECT   50   13                                                      
CONECT   51   13                                                      
CONECT   52   16                                                      
CONECT   53   18                                                      
CONECT   54   18                                                      
CONECT   55   24                                                      
CONECT   56   24                                                      
CONECT   57   26                                                      
CONECT   58   26                                                      
CONECT   59   26                                                      
CONECT   60   27                                                      
CONECT   61   28                                                      
CONECT   62   29                                                      
CONECT   63   30                                                      
CONECT   64   31                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   34                                                      
CONECT   68   36                                                      
CONECT   69   36                                                      
CONECT   70   36                                                      
CONECT   71   37                                                      
CONECT   72   37                                                      
CONECT   73   37                                                      
CONECT   74   38                                                      
CONECT   75   38                                                      
CONECT   76   38                                                      
MASTER        0    0    0    0    0    0    0    0   76    0   76    0
END
