COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.883  -1.062   0.023  1.00  0.00           C  
HETATM    2  C   UNL     1       0.495  -0.568   0.107  1.00  0.00           C  
HETATM    3  C   UNL     1      -1.824  -0.414   0.664  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.201   0.275   0.497  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.481   2.398  -0.370  1.00  0.00           C  
HETATM    6  C   UNL     1      -6.311  -2.071  -0.213  1.00  0.00           C  
HETATM    7  C   UNL     1       5.951  -3.871  -0.203  1.00  0.00           C  
HETATM    8  O   UNL     1       5.768  -2.453  -0.212  1.00  0.00           O  
HETATM    9  C   UNL     1       4.491  -1.995  -0.135  1.00  0.00           C  
HETATM   10  C   UNL     1       4.242  -0.624  -0.139  1.00  0.00           C  
HETATM   11  O   UNL     1       5.278   0.254  -0.220  1.00  0.00           O  
HETATM   12  C   UNL     1       4.946   1.638  -0.342  1.00  0.00           C  
HETATM   13  C   UNL     1       6.103   2.415  -1.003  1.00  0.00           C  
HETATM   14  C   UNL     1       6.175   3.781  -0.298  1.00  0.00           C  
HETATM   15  C   UNL     1       5.058   3.787   0.767  1.00  0.00           C  
HETATM   16  C   UNL     1       4.799   2.286   1.057  1.00  0.00           C  
HETATM   17  C   UNL     1       2.944  -0.157  -0.060  1.00  0.00           C  
HETATM   18  C   UNL     1       2.140  -2.435   0.032  1.00  0.00           C  
HETATM   19  C   UNL     1       3.437  -2.894  -0.047  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.749  -1.429   0.208  1.00  0.00           C  
HETATM   21  C   UNL     1      -3.169  -0.702  -0.006  1.00  0.00           C  
HETATM   22  O   UNL     1      -3.891   1.119   1.310  1.00  0.00           O  
HETATM   23  N   UNL     1      -5.468   0.211   0.042  1.00  0.00           N  
HETATM   24  O   UNL     1      -1.270   0.832   0.197  1.00  0.00           O  
HETATM   25  N   UNL     1       0.132   0.671   0.114  1.00  0.00           N  
HETATM   26  C   UNL     1      -5.842  -0.809  -0.941  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.470   1.161   0.530  1.00  0.00           C  
HETATM   28  O   UNL     1      -6.916   2.030  -1.681  1.00  0.00           O  
HETATM   29  O   UNL     1      -7.509  -1.786   0.511  1.00  0.00           O  
HETATM   30  H   UNL     1      -1.924  -0.412   1.750  1.00  0.00           H  
HETATM   31  H   UNL     1      -7.163   3.142   0.043  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.476   2.816  -0.424  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.505  -2.859  -0.941  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.537  -2.399   0.480  1.00  0.00           H  
HETATM   35  H   UNL     1       5.547  -4.283   0.721  1.00  0.00           H  
HETATM   36  H   UNL     1       5.430  -4.309  -1.055  1.00  0.00           H  
HETATM   37  H   UNL     1       7.014  -4.100  -0.270  1.00  0.00           H  
HETATM   38  H   UNL     1       4.028   1.760  -0.917  1.00  0.00           H  
HETATM   39  H   UNL     1       7.041   1.875  -0.867  1.00  0.00           H  
HETATM   40  H   UNL     1       5.903   2.553  -2.065  1.00  0.00           H  
HETATM   41  H   UNL     1       7.147   3.904   0.180  1.00  0.00           H  
HETATM   42  H   UNL     1       6.010   4.582  -1.018  1.00  0.00           H  
HETATM   43  H   UNL     1       5.394   4.298   1.669  1.00  0.00           H  
HETATM   44  H   UNL     1       4.158   4.258   0.372  1.00  0.00           H  
HETATM   45  H   UNL     1       3.795   2.137   1.452  1.00  0.00           H  
HETATM   46  H   UNL     1       5.548   1.891   1.744  1.00  0.00           H  
HETATM   47  H   UNL     1       2.750   0.906  -0.063  1.00  0.00           H  
HETATM   48  H   UNL     1       1.321  -3.136   0.100  1.00  0.00           H  
HETATM   49  H   UNL     1       3.634  -3.956  -0.045  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.005  -1.854  -0.762  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.618  -2.214   0.953  1.00  0.00           H  
HETATM   52  H   UNL     1      -3.067  -0.599  -1.086  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.484  -1.718   0.234  1.00  0.00           H  
HETATM   54  H   UNL     1      -4.980  -1.048  -1.564  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.650  -0.430  -1.568  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.225   1.455   1.550  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.454   0.691   0.514  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.947   2.767  -2.306  1.00  0.00           H  
HETATM   59  H   UNL     1      -7.864  -2.542   0.998  1.00  0.00           H  
CONECT    1   17   17   18    2                                       
CONECT    2    1   25   25   20                                       
CONECT    3   24   20   21   30                                       
CONECT    4   21   22   22   23                                       
CONECT    5   27   28   31   32                                       
CONECT    6   26   29   33   34                                       
CONECT    7    8   35   36   37                                       
CONECT    8    7    9                                                 
CONECT    9    8   10   10   19                                       
CONECT   10   11    9    9   17                                       
CONECT   11   10   12                                                 
CONECT   12   11   16   13   38                                       
CONECT   13   14   12   39   40                                       
CONECT   14   15   13   41   42                                       
CONECT   15   14   16   43   44                                       
CONECT   16   15   12   45   46                                       
CONECT   17   10    1    1   47                                       
CONECT   18   19   19    1   48                                       
CONECT   19    9   18   18   49                                       
CONECT   20    2    3   50   51                                       
CONECT   21    3    4   52   53                                       
CONECT   22    4    4                                                 
CONECT   23    4   26   27                                            
CONECT   24   25    3                                                 
CONECT   25    2    2   24                                            
CONECT   26   23    6   54   55                                       
CONECT   27   23    5   56   57                                       
CONECT   28    5   58                                                 
CONECT   29    6   59                                                 
CONECT   30    3                                                      
CONECT   31    5                                                      
CONECT   32    5                                                      
CONECT   33    6                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38   12                                                      
CONECT   39   13                                                      
CONECT   40   13                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   16                                                      
CONECT   46   16                                                      
CONECT   47   17                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   20                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   26                                                      
CONECT   55   26                                                      
CONECT   56   27                                                      
CONECT   57   27                                                      
CONECT   58   28                                                      
CONECT   59   29                                                      
MASTER        0    0    0    0    0    0    0    0   59    0   59    0
END
