COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.822   0.609   0.000  1.00  0.00           N  
HETATM    2  C   UNL     1      -5.188   0.321  -0.094  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.637  -0.982   0.065  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.988  -1.263  -0.029  1.00  0.00           C  
HETATM    5  C   UNL     1      -7.893  -0.248  -0.281  1.00  0.00           C  
HETATM    6  C   UNL     1      -7.452   1.053  -0.441  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.101   1.344  -0.343  1.00  0.00           C  
HETATM    8  O   UNL     1      -5.667   2.624  -0.495  1.00  0.00           O  
HETATM    9  C   UNL     1      -6.660   3.620  -0.747  1.00  0.00           C  
HETATM   10 CL   UNL     1      -7.548  -2.894   0.170  1.00  0.00          Cl  
HETATM   11  C   UNL     1      -2.862  -0.468   0.256  1.00  0.00           C  
HETATM   12  C   UNL     1      -1.469   0.103   0.311  1.00  0.00           C  
HETATM   13  O   UNL     1      -1.294   1.293   0.153  1.00  0.00           O  
HETATM   14  N   UNL     1      -0.416  -0.708   0.536  1.00  0.00           N  
HETATM   15  C   UNL     1       0.938  -0.153   0.590  1.00  0.00           C  
HETATM   16  C   UNL     1       1.831  -1.066   1.434  1.00  0.00           C  
HETATM   17  C   UNL     1       3.245  -0.486   1.490  1.00  0.00           C  
HETATM   18  C   UNL     1       1.506  -0.054  -0.827  1.00  0.00           C  
HETATM   19  C   UNL     1       2.921   0.526  -0.771  1.00  0.00           C  
HETATM   20  C   UNL     1       3.813  -0.387   0.073  1.00  0.00           C  
HETATM   21  N   UNL     1       5.167   0.168   0.127  1.00  0.00           N  
HETATM   22  C   UNL     1       5.506   1.373   0.624  1.00  0.00           C  
HETATM   23  O   UNL     1       4.728   2.177   1.102  1.00  0.00           O  
HETATM   24  N   UNL     1       6.835   1.552   0.512  1.00  0.00           N  
HETATM   25  C   UNL     1       7.383   0.417  -0.083  1.00  0.00           C  
HETATM   26  C   UNL     1       6.325  -0.463  -0.322  1.00  0.00           C  
HETATM   27  C   UNL     1       6.571  -1.694  -0.909  1.00  0.00           C  
HETATM   28  C   UNL     1       7.862  -2.047  -1.252  1.00  0.00           C  
HETATM   29  C   UNL     1       8.911  -1.176  -1.012  1.00  0.00           C  
HETATM   30  C   UNL     1       8.674   0.056  -0.435  1.00  0.00           C  
HETATM   31  H   UNL     1      -3.509   1.521  -0.107  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.932  -1.776   0.261  1.00  0.00           H  
HETATM   33  H   UNL     1      -8.947  -0.472  -0.353  1.00  0.00           H  
HETATM   34  H   UNL     1      -8.161   1.843  -0.638  1.00  0.00           H  
HETATM   35  H   UNL     1      -7.189   3.379  -1.669  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.366   3.647   0.082  1.00  0.00           H  
HETATM   37  H   UNL     1      -6.180   4.594  -0.847  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.097  -0.946   1.207  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.921  -1.205  -0.546  1.00  0.00           H  
HETATM   40  H   UNL     1      -0.556  -1.660   0.663  1.00  0.00           H  
HETATM   41  H   UNL     1       0.907   0.840   1.039  1.00  0.00           H  
HETATM   42  H   UNL     1       1.426  -1.137   2.444  1.00  0.00           H  
HETATM   43  H   UNL     1       1.862  -2.059   0.985  1.00  0.00           H  
HETATM   44  H   UNL     1       3.214   0.507   1.939  1.00  0.00           H  
HETATM   45  H   UNL     1       3.881  -1.137   2.091  1.00  0.00           H  
HETATM   46  H   UNL     1       1.538  -1.047  -1.276  1.00  0.00           H  
HETATM   47  H   UNL     1       0.870   0.596  -1.428  1.00  0.00           H  
HETATM   48  H   UNL     1       3.325   0.597  -1.781  1.00  0.00           H  
HETATM   49  H   UNL     1       2.889   1.519  -0.322  1.00  0.00           H  
HETATM   50  H   UNL     1       3.844  -1.380  -0.376  1.00  0.00           H  
HETATM   51  H   UNL     1       7.328   2.338   0.796  1.00  0.00           H  
HETATM   52  H   UNL     1       5.755  -2.376  -1.098  1.00  0.00           H  
HETATM   53  H   UNL     1       8.054  -3.006  -1.710  1.00  0.00           H  
HETATM   54  H   UNL     1       9.917  -1.458  -1.283  1.00  0.00           H  
HETATM   55  H   UNL     1       9.495   0.733  -0.248  1.00  0.00           H  
CONECT    1   11    2   31                                            
CONECT    2    1    7    7    3                                       
CONECT    3    2    4    4   32                                       
CONECT    4    3    3    5   10                                       
CONECT    5    6    6    4   33                                       
CONECT    6    7    5    5   34                                       
CONECT    7    8    2    2    6                                       
CONECT    8    9    7                                                 
CONECT    9    8   35   36   37                                       
CONECT   10    4                                                      
CONECT   11   12    1   38   39                                       
CONECT   12   13   13   11   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   40                                            
CONECT   15   18   14   16   41                                       
CONECT   16   15   17   42   43                                       
CONECT   17   20   16   44   45                                       
CONECT   18   19   15   46   47                                       
CONECT   19   18   20   48   49                                       
CONECT   20   19   21   17   50                                       
CONECT   21   22   20   26                                            
CONECT   22   23   23   24   21                                       
CONECT   23   22   22                                                 
CONECT   24   22   25   51                                            
CONECT   25   24   26   26   30                                       
CONECT   26   21   25   25   27                                       
CONECT   27   26   28   28   52                                       
CONECT   28   27   27   29   53                                       
CONECT   29   30   30   28   54                                       
CONECT   30   25   29   29   55                                       
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    9                                                      
CONECT   36    9                                                      
CONECT   37    9                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   14                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   16                                                      
CONECT   44   17                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   19                                                      
CONECT   49   19                                                      
CONECT   50   20                                                      
CONECT   51   24                                                      
CONECT   52   27                                                      
CONECT   53   28                                                      
CONECT   54   29                                                      
CONECT   55   30                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
