COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.502  -0.827  -0.733  1.00  0.00           C  
HETATM    2  C   UNL     1      -0.385   0.205  -1.676  1.00  0.00           C  
HETATM    3  C   UNL     1      -2.497  -0.128  -1.224  1.00  0.00           C  
HETATM    4  C   UNL     1      -4.695  -0.868  -0.401  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.841   1.172  -0.844  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.778   0.353   1.406  1.00  0.00           C  
HETATM    7  C   UNL     1       2.306   1.958  -3.450  1.00  0.00           C  
HETATM    8  C   UNL     1       3.112  -1.721  -0.192  1.00  0.00           C  
HETATM    9  C   UNL     1       6.142  -0.917   1.474  1.00  0.00           C  
HETATM   10  C   UNL     1       4.984   1.099   0.878  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.573  -0.274   1.143  1.00  0.00           C  
HETATM   12 CL   UNL     1      -8.488   0.243   2.986  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -8.409   1.080   0.412  1.00  0.00           C  
HETATM   14  C   UNL     1      -6.642   0.537  -1.109  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.008  -0.186  -0.115  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.954  -2.189  -1.128  1.00  0.00           C  
HETATM   17  N   UNL     1      -3.867  -0.002  -1.243  1.00  0.00           N  
HETATM   18  O   UNL     1      -1.645   0.612  -1.954  1.00  0.00           O  
HETATM   19  N   UNL     1      -1.834  -0.988  -0.494  1.00  0.00           N  
HETATM   20  C   UNL     1       0.642  -1.459  -0.250  1.00  0.00           C  
HETATM   21  C   UNL     1       0.872   0.602  -2.123  1.00  0.00           C  
HETATM   22  O   UNL     1       0.985   1.603  -3.036  1.00  0.00           O  
HETATM   23  C   UNL     1       2.005  -0.022  -1.639  1.00  0.00           C  
HETATM   24  C   UNL     1       1.895  -1.055  -0.701  1.00  0.00           C  
HETATM   25  O   UNL     1       3.077  -2.896   0.118  1.00  0.00           O  
HETATM   26  N   UNL     1       4.260  -1.026  -0.070  1.00  0.00           N  
HETATM   27  C   UNL     1       4.297   0.425  -0.314  1.00  0.00           C  
HETATM   28  C   UNL     1       5.514  -1.694   0.312  1.00  0.00           C  
HETATM   29  C   UNL     1       5.219  -3.130   0.752  1.00  0.00           C  
HETATM   30  C   UNL     1       6.521  -3.809   1.182  1.00  0.00           C  
HETATM   31  O   UNL     1       6.242   0.464   1.117  1.00  0.00           O  
HETATM   32  C   UNL     1       4.100   0.967   2.120  1.00  0.00           C  
HETATM   33  C   UNL     1       5.210   2.580   0.568  1.00  0.00           C  
HETATM   34  C   UNL     1       5.897   3.252   1.759  1.00  0.00           C  
HETATM   35  O   UNL     1       6.108   4.635   1.469  1.00  0.00           O  
HETATM   36  H   UNL     1      -4.176  -1.066   0.538  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.336   1.735  -1.621  1.00  0.00           H  
HETATM   38  H   UNL     1       2.789   1.092  -3.903  1.00  0.00           H  
HETATM   39  H   UNL     1       2.253   2.767  -4.178  1.00  0.00           H  
HETATM   40  H   UNL     1       2.882   2.284  -2.585  1.00  0.00           H  
HETATM   41  H   UNL     1       5.516  -1.020   2.361  1.00  0.00           H  
HETATM   42  H   UNL     1       7.136  -1.313   1.682  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.073  -0.832   1.922  1.00  0.00           H  
HETATM   44  H   UNL     1      -9.346   1.577   0.619  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.200   0.605  -2.092  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.570  -2.834  -0.501  1.00  0.00           H  
HETATM   47  H   UNL     1      -5.473  -1.992  -2.066  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.004  -2.683  -1.334  1.00  0.00           H  
HETATM   49  H   UNL     1      -4.285   0.662  -1.814  1.00  0.00           H  
HETATM   50  H   UNL     1       0.557  -2.257   0.472  1.00  0.00           H  
HETATM   51  H   UNL     1       2.980   0.287  -1.987  1.00  0.00           H  
HETATM   52  H   UNL     1       3.280   0.806  -0.416  1.00  0.00           H  
HETATM   53  H   UNL     1       4.858   0.630  -1.226  1.00  0.00           H  
HETATM   54  H   UNL     1       6.198  -1.703  -0.536  1.00  0.00           H  
HETATM   55  H   UNL     1       4.522  -3.117   1.589  1.00  0.00           H  
HETATM   56  H   UNL     1       4.779  -3.681  -0.079  1.00  0.00           H  
HETATM   57  H   UNL     1       7.254  -3.730   0.380  1.00  0.00           H  
HETATM   58  H   UNL     1       6.907  -3.321   2.077  1.00  0.00           H  
HETATM   59  H   UNL     1       6.328  -4.860   1.396  1.00  0.00           H  
HETATM   60  H   UNL     1       3.940  -0.089   2.342  1.00  0.00           H  
HETATM   61  H   UNL     1       4.589   1.446   2.967  1.00  0.00           H  
HETATM   62  H   UNL     1       3.139   1.448   1.935  1.00  0.00           H  
HETATM   63  H   UNL     1       5.842   2.674  -0.316  1.00  0.00           H  
HETATM   64  H   UNL     1       4.251   3.063   0.381  1.00  0.00           H  
HETATM   65  H   UNL     1       5.265   3.158   2.642  1.00  0.00           H  
HETATM   66  H   UNL     1       6.856   2.769   1.945  1.00  0.00           H  
HETATM   67  H   UNL     1       6.540   5.125   2.182  1.00  0.00           H  
CONECT    1   20   19    2    2                                       
CONECT    2    1    1   21   18                                       
CONECT    3   19   19   17   18                                       
CONECT    4   15   17   16   36                                       
CONECT    5   13   14   14   37                                       
CONECT    6   12   13   13   11                                       
CONECT    7   22   38   39   40                                       
CONECT    8   26   25   25   24                                       
CONECT    9   31   28   41   42                                       
CONECT   10   32   31   27   33                                       
CONECT   11    6   15   15   43                                       
CONECT   12    6                                                      
CONECT   13    6    6    5   44                                       
CONECT   14    5    5   15   45                                       
CONECT   15   11   11   14    4                                       
CONECT   16    4   46   47   48                                       
CONECT   17    3    4   49                                            
CONECT   18    2    3                                                 
CONECT   19    1    3    3                                            
CONECT   20   24   24    1   50                                       
CONECT   21   23   23    2   22                                       
CONECT   22   21    7                                                 
CONECT   23   24   21   21   51                                       
CONECT   24    8   20   20   23                                       
CONECT   25    8    8                                                 
CONECT   26   28   27    8                                            
CONECT   27   10   26   52   53                                       
CONECT   28   29    9   26   54                                       
CONECT   29   30   28   55   56                                       
CONECT   30   29   57   58   59                                       
CONECT   31    9   10                                                 
CONECT   32   10   60   61   62                                       
CONECT   33   10   34   63   64                                       
CONECT   34   33   35   65   66                                       
CONECT   35   34   67                                                 
CONECT   36    4                                                      
CONECT   37    5                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    7                                                      
CONECT   41    9                                                      
CONECT   42    9                                                      
CONECT   43   11                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   16                                                      
CONECT   49   17                                                      
CONECT   50   20                                                      
CONECT   51   23                                                      
CONECT   52   27                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   29                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   30                                                      
CONECT   60   32                                                      
CONECT   61   32                                                      
CONECT   62   32                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   34                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
MASTER        0    0    0    0    0    0    0    0   67    0   67    0
END
