COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.756   2.331   1.143  1.00  0.00           C  
HETATM    2  C   UNL     1       0.936   4.051  -0.383  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.233   2.276  -1.726  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.395   2.465  -0.480  1.00  0.00           C  
HETATM    5  C   UNL     1      -4.492  -0.030   1.426  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.073  -1.655  -0.274  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.749  -0.900   1.299  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.317   0.330  -0.585  1.00  0.00           C  
HETATM    9  N   UNL     1       5.936  -4.100  -0.195  1.00  0.00           N  
HETATM   10  C   UNL     1       4.907  -3.182  -0.112  1.00  0.00           C  
HETATM   11  N   UNL     1       3.588  -3.458  -0.153  1.00  0.00           N  
HETATM   12  N   UNL     1       2.855  -2.274  -0.040  1.00  0.00           N  
HETATM   13  C   UNL     1       3.681  -1.259   0.070  1.00  0.00           C  
HETATM   14  C   UNL     1       3.308   0.168   0.211  1.00  0.00           C  
HETATM   15  C   UNL     1       2.185   0.656  -0.446  1.00  0.00           C  
HETATM   16  C   UNL     1       1.844   1.997  -0.321  1.00  0.00           C  
HETATM   17  C   UNL     1       2.633   2.840   0.484  1.00  0.00           C  
HETATM   18  C   UNL     1       4.089   1.016   1.005  1.00  0.00           C  
HETATM   19  C   UNL     1       2.009   4.163   0.417  1.00  0.00           C  
HETATM   20  N   UNL     1       0.821   2.764  -0.833  1.00  0.00           N  
HETATM   21  C   UNL     1      -1.346   1.674  -0.908  1.00  0.00           C  
HETATM   22  C   UNL     1      -3.414   1.914   0.275  1.00  0.00           C  
HETATM   23  C   UNL     1      -3.382   0.571   0.603  1.00  0.00           C  
HETATM   24  N   UNL     1      -5.550  -0.524   0.535  1.00  0.00           N  
HETATM   25  C   UNL     1      -6.185  -2.100  -1.227  1.00  0.00           C  
HETATM   26  O   UNL     1      -7.351  -2.431  -0.470  1.00  0.00           O  
HETATM   27  C   UNL     1      -7.845  -1.352   0.329  1.00  0.00           C  
HETATM   28  C   UNL     1      -2.332  -0.220   0.175  1.00  0.00           C  
HETATM   29  C   UNL     1       5.043  -1.805   0.034  1.00  0.00           C  
HETATM   30  C   UNL     1       6.267  -1.067   0.123  1.00  0.00           C  
HETATM   31  N   UNL     1       7.238  -0.481   0.193  1.00  0.00           N  
HETATM   32  H   UNL     1       4.363   2.981   1.756  1.00  0.00           H  
HETATM   33  H   UNL     1       0.263   4.858  -0.633  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.623   3.105  -2.316  1.00  0.00           H  
HETATM   35  H   UNL     1       0.179   1.518  -2.393  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.418   3.515  -0.733  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.099  -0.857   2.017  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.903   0.730   2.092  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.200  -1.347  -0.850  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.802  -2.483   0.382  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.506  -1.716   1.980  1.00  0.00           H  
HETATM   42  H   UNL     1      -7.100  -0.041   1.871  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.497  -0.288  -0.919  1.00  0.00           H  
HETATM   44  H   UNL     1       5.737  -5.044  -0.292  1.00  0.00           H  
HETATM   45  H   UNL     1       6.858  -3.799  -0.156  1.00  0.00           H  
HETATM   46  H   UNL     1       3.205  -4.345  -0.246  1.00  0.00           H  
HETATM   47  H   UNL     1       1.586  -0.001  -1.058  1.00  0.00           H  
HETATM   48  H   UNL     1       4.959   0.627   1.511  1.00  0.00           H  
HETATM   49  H   UNL     1       2.348   5.059   0.915  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.234   2.532   0.609  1.00  0.00           H  
HETATM   51  H   UNL     1      -6.417  -1.290  -1.918  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.854  -2.974  -1.789  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.715  -1.686   0.893  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.126  -0.520  -0.317  1.00  0.00           H  
HETATM   55  H   UNL     1      -2.307  -1.269   0.432  1.00  0.00           H  
CONECT    1   17   18   18   32                                       
CONECT    2   19   19   20   33                                       
CONECT    3   21   20   34   35                                       
CONECT    4   22   21   21   36                                       
CONECT    5   24   23   37   38                                       
CONECT    6   25   24   39   40                                       
CONECT    7   27   24   41   42                                       
CONECT    8   28   28   21   43                                       
CONECT    9   10   44   45                                            
CONECT   10   29   29   11    9                                       
CONECT   11   12   10   46                                            
CONECT   12   13   13   11                                            
CONECT   13   14   12   12   29                                       
CONECT   14   15   15   18   13                                       
CONECT   15   16   14   14   47                                       
CONECT   16   20   17   17   15                                       
CONECT   17   19   16   16    1                                       
CONECT   18    1    1   14   48                                       
CONECT   19    2    2   17   49                                       
CONECT   20    2    3   16                                            
CONECT   21    4    4    8    3                                       
CONECT   22   23   23    4   50                                       
CONECT   23    5   22   22   28                                       
CONECT   24    7    5    6                                            
CONECT   25   26    6   51   52                                       
CONECT   26   27   25                                                 
CONECT   27   26    7   53   54                                       
CONECT   28   23    8    8   55                                       
CONECT   29   13   30   10   10                                       
CONECT   30   31   31   31   29                                       
CONECT   31   30   30   30                                            
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    3                                                      
CONECT   35    3                                                      
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    6                                                      
CONECT   41    7                                                      
CONECT   42    7                                                      
CONECT   43    8                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   11                                                      
CONECT   47   15                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   22                                                      
CONECT   51   25                                                      
CONECT   52   25                                                      
CONECT   53   27                                                      
CONECT   54   27                                                      
CONECT   55   28                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
