COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -0.433  -0.331  -0.401  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.101  -1.216   0.310  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.466  -2.112   1.181  1.00  0.00           C  
HETATM    4  C   UNL     1       0.917  -2.075   1.307  1.00  0.00           C  
HETATM    5  C   UNL     1       1.637  -1.083   0.507  1.00  0.00           C  
HETATM    6  C   UNL     1       0.891  -0.223  -0.344  1.00  0.00           C  
HETATM    7  C   UNL     1       3.027  -0.970   0.567  1.00  0.00           C  
HETATM    8  C   UNL     1       3.666  -0.016  -0.209  1.00  0.00           C  
HETATM    9  C   UNL     1       2.925   0.831  -1.049  1.00  0.00           C  
HETATM   10  C   UNL     1       1.573   0.736  -1.120  1.00  0.00           C  
HETATM   11  C   UNL     1      -2.577  -1.266   0.184  1.00  0.00           C  
HETATM   12  C   UNL     1       1.632  -2.998   2.212  1.00  0.00           C  
HETATM   13  C   UNL     1       5.142   0.111  -0.151  1.00  0.00           C  
HETATM   14  O   UNL     1      -3.215  -2.074   0.830  1.00  0.00           O  
HETATM   15  N   UNL     1      -3.212  -0.415  -0.646  1.00  0.00           N  
HETATM   16  C   UNL     1      -4.671  -0.464  -0.770  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.190   0.901  -1.226  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.916   1.925  -0.155  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.054  -1.511  -1.784  1.00  0.00           C  
HETATM   20  O   UNL     1      -4.196  -2.151  -2.346  1.00  0.00           O  
HETATM   21  O   UNL     1      -6.348  -1.734  -2.064  1.00  0.00           O  
HETATM   22  C   UNL     1      -6.643  -2.757  -3.050  1.00  0.00           C  
HETATM   23  O   UNL     1       2.846  -3.014   2.227  1.00  0.00           O  
HETATM   24  O   UNL     1       0.937  -3.822   3.020  1.00  0.00           O  
HETATM   25  C   UNL     1       5.793   1.067  -0.928  1.00  0.00           C  
HETATM   26  C   UNL     1       7.168   1.181  -0.871  1.00  0.00           C  
HETATM   27  C   UNL     1       7.900   0.347  -0.043  1.00  0.00           C  
HETATM   28  C   UNL     1       7.259  -0.604   0.730  1.00  0.00           C  
HETATM   29  C   UNL     1       5.885  -0.723   0.685  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.727   2.632  -0.165  1.00  0.00           C  
HETATM   31  C   UNL     1      -3.473   3.572   0.815  1.00  0.00           C  
HETATM   32  C   UNL     1      -4.411   3.806   1.809  1.00  0.00           C  
HETATM   33  C   UNL     1      -5.603   3.096   1.817  1.00  0.00           C  
HETATM   34  C   UNL     1      -5.855   2.161   0.832  1.00  0.00           C  
HETATM   35 CL   UNL     1       7.981   2.372  -1.837  1.00  0.00          Cl  
HETATM   36  O   UNL     1      -4.163   4.730   2.775  1.00  0.00           O  
HETATM   37  H   UNL     1      -1.047  -2.825   1.748  1.00  0.00           H  
HETATM   38  H   UNL     1       3.600  -1.620   1.212  1.00  0.00           H  
HETATM   39  H   UNL     1       3.439   1.569  -1.647  1.00  0.00           H  
HETATM   40  H   UNL     1       1.020   1.396  -1.772  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.703   0.230  -1.162  1.00  0.00           H  
HETATM   42  H   UNL     1      -5.109  -0.716   0.195  1.00  0.00           H  
HETATM   43  H   UNL     1      -4.686   1.193  -2.147  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.264   0.840  -1.403  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.180  -2.490  -4.000  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.248  -3.714  -2.710  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.722  -2.835  -3.182  1.00  0.00           H  
HETATM   48  H   UNL     1       1.448  -4.408   3.595  1.00  0.00           H  
HETATM   49  H   UNL     1       5.223   1.718  -1.575  1.00  0.00           H  
HETATM   50  H   UNL     1       8.975   0.439   0.000  1.00  0.00           H  
HETATM   51  H   UNL     1       7.834  -1.253   1.374  1.00  0.00           H  
HETATM   52  H   UNL     1       5.386  -1.466   1.289  1.00  0.00           H  
HETATM   53  H   UNL     1      -2.997   2.449  -0.940  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.545   4.124   0.807  1.00  0.00           H  
HETATM   55  H   UNL     1      -6.335   3.276   2.591  1.00  0.00           H  
HETATM   56  H   UNL     1      -6.782   1.608   0.837  1.00  0.00           H  
HETATM   57  H   UNL     1      -4.467   5.621   2.554  1.00  0.00           H  
CONECT    1    2    2    6                                            
CONECT    2   11    1    1    3                                       
CONECT    3    2    4    4   37                                       
CONECT    4    3    3    5   12                                       
CONECT    5    6    4    7    7                                       
CONECT    6    1   10   10    5                                       
CONECT    7    5    5    8   38                                       
CONECT    8    9    9    7   13                                       
CONECT    9   10    8    8   39                                       
CONECT   10    6    6    9   40                                       
CONECT   11   14   14   15    2                                       
CONECT   12    4   23   23   24                                       
CONECT   13   29    8   25   25                                       
CONECT   14   11   11                                                 
CONECT   15   16   11   41                                            
CONECT   16   17   19   15   42                                       
CONECT   17   18   16   43   44                                       
CONECT   18   34   34   30   17                                       
CONECT   19   21   16   20   20                                       
CONECT   20   19   19                                                 
CONECT   21   22   19                                                 
CONECT   22   21   45   46   47                                       
CONECT   23   12   12                                                 
CONECT   24   12   48                                                 
CONECT   25   13   13   26   49                                       
CONECT   26   27   27   25   35                                       
CONECT   27   28   26   26   50                                       
CONECT   28   29   29   27   51                                       
CONECT   29   28   28   13   52                                       
CONECT   30   31   31   18   53                                       
CONECT   31   32   30   30   54                                       
CONECT   32   36   33   33   31                                       
CONECT   33   32   32   34   55                                       
CONECT   34   33   18   18   56                                       
CONECT   35   26                                                      
CONECT   36   32   57                                                 
CONECT   37    3                                                      
CONECT   38    7                                                      
CONECT   39    9                                                      
CONECT   40   10                                                      
CONECT   41   15                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   22                                                      
CONECT   46   22                                                      
CONECT   47   22                                                      
CONECT   48   24                                                      
CONECT   49   25                                                      
CONECT   50   27                                                      
CONECT   51   28                                                      
CONECT   52   29                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   33                                                      
CONECT   56   34                                                      
CONECT   57   36                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
