COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.0.0
HETATM    1  C   UNL     1       7.935   0.258   0.652  1.00  0.00           C  
HETATM    2  C   UNL     1       7.686   1.745   0.912  1.00  0.00           C  
HETATM    3  C   UNL     1       8.624   2.234   2.017  1.00  0.00           C  
HETATM    4  C   UNL     1       7.949   2.538  -0.369  1.00  0.00           C  
HETATM    5  C   UNL     1       4.558   0.353  -0.542  1.00  0.00           C  
HETATM    6  C   UNL     1       3.203   0.480   0.027  1.00  0.00           C  
HETATM    7  C   UNL     1       2.104   0.960  -0.626  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.306   1.319  -0.008  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.034   0.115   0.010  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.308   1.405  -0.456  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.394  -0.387  -0.015  1.00  0.00           C  
HETATM   12  C   UNL     1      -6.087  -0.785   0.228  1.00  0.00           C  
HETATM   13  C   UNL     1      -5.733  -3.073  -0.309  1.00  0.00           C  
HETATM   14  C   UNL     1      -8.960  -1.316   1.517  1.00  0.00           C  
HETATM   15  C   UNL     1      -9.130   2.622  -1.183  1.00  0.00           C  
HETATM   16  N   UNL     1       5.562  -0.137   0.211  1.00  0.00           N  
HETATM   17  C   UNL     1       6.908  -0.263  -0.355  1.00  0.00           C  
HETATM   18  O   UNL     1       4.769   0.691  -1.691  1.00  0.00           O  
HETATM   19  N   UNL     1       1.077   0.908   0.246  1.00  0.00           N  
HETATM   20  O   UNL     1      -3.406  -1.423   0.666  1.00  0.00           O  
HETATM   21  N   UNL     1       1.587   0.384   1.442  1.00  0.00           N  
HETATM   22  O   UNL     1      -5.828  -2.041   0.675  1.00  0.00           O  
HETATM   23  N   UNL     1       2.841   0.138   1.276  1.00  0.00           N  
HETATM   24  O   UNL     1      -8.420  -1.255   0.195  1.00  0.00           O  
HETATM   25  N   UNL     1      -2.633   0.568   0.055  1.00  0.00           N  
HETATM   26  O   UNL     1      -8.934   1.288  -0.709  1.00  0.00           O  
HETATM   27  O   UNL     1       8.479  -1.921  -1.166  1.00  0.00           O  
HETATM   28  O   UNL     1       7.089  -2.536   0.470  1.00  0.00           O  
HETATM   29  C   UNL     1      -1.250   0.157   0.308  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.643  -0.299   0.265  1.00  0.00           C  
HETATM   31  C   UNL     1      -6.608   1.789  -0.693  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.654   0.900  -0.472  1.00  0.00           C  
HETATM   33  B   UNL     1       7.209  -1.799  -0.675  1.00  0.00           B  
HETATM   34  H   UNL     1       8.939   0.123   0.250  1.00  0.00           H  
HETATM   35  H   UNL     1       7.841  -0.295   1.587  1.00  0.00           H  
HETATM   36  H   UNL     1       6.651   1.890   1.224  1.00  0.00           H  
HETATM   37  H   UNL     1       9.658   2.089   1.706  1.00  0.00           H  
HETATM   38  H   UNL     1       8.446   3.293   2.202  1.00  0.00           H  
HETATM   39  H   UNL     1       8.436   1.669   2.930  1.00  0.00           H  
HETATM   40  H   UNL     1       8.955   2.322  -0.730  1.00  0.00           H  
HETATM   41  H   UNL     1       7.222   2.253  -1.129  1.00  0.00           H  
HETATM   42  H   UNL     1       7.858   3.604  -0.162  1.00  0.00           H  
HETATM   43  H   UNL     1       2.065   1.313  -1.646  1.00  0.00           H  
HETATM   44  H   UNL     1      -0.553   2.171   0.626  1.00  0.00           H  
HETATM   45  H   UNL     1      -0.415   1.601  -1.055  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.499   2.099  -0.629  1.00  0.00           H  
HETATM   47  H   UNL     1      -6.650  -3.099  -0.898  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.886  -2.872  -0.965  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.592  -4.034   0.184  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.420  -0.359   1.765  1.00  0.00           H  
HETATM   51  H   UNL     1      -9.711  -2.104   1.567  1.00  0.00           H  
HETATM   52  H   UNL     1      -8.160  -1.530   2.226  1.00  0.00           H  
HETATM   53  H   UNL     1      -8.740   3.329  -0.451  1.00  0.00           H  
HETATM   54  H   UNL     1      -8.604   2.752  -2.130  1.00  0.00           H  
HETATM   55  H   UNL     1     -10.194   2.802  -1.331  1.00  0.00           H  
HETATM   56  H   UNL     1       5.394  -0.407   1.128  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.821   1.464  -0.265  1.00  0.00           H  
HETATM   58  H   UNL     1       8.656  -1.372  -1.942  1.00  0.00           H  
HETATM   59  H   UNL     1       6.212  -2.495   0.874  1.00  0.00           H  
HETATM   60  H   UNL     1      -1.002  -0.695  -0.325  1.00  0.00           H  
HETATM   61  H   UNL     1      -1.141  -0.125   1.355  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.816   2.786  -1.053  1.00  0.00           H  
HETATM   63  O   UNL     1       6.316  -2.253  -1.605  1.00  0.00           O  
HETATM   64  H   UNL     1       6.439  -3.181  -1.849  1.00  0.00           H  
HETATM   65  H   UNL     1       6.972   0.319  -1.274  1.00  0.00           H  
CONECT    1    2   17   34   35                                       
CONECT    2    4    3    1   36                                       
CONECT    3    2   37   38   39                                       
CONECT    4    2   40   41   42                                       
CONECT    5   16    6   18   18                                       
CONECT    6   23    5    7    7                                       
CONECT    7   19    6    6   43                                       
CONECT    8   19   29   44   45                                       
CONECT    9   10   30   12   12                                       
CONECT   10   31   31    9   46                                       
CONECT   11   32   32   12   24                                       
CONECT   12    9    9   11   22                                       
CONECT   13   22   47   48   49                                       
CONECT   14   24   50   51   52                                       
CONECT   15   26   53   54   55                                       
CONECT   16   17    5   56                                            
CONECT   17    1   16   33   65                                       
CONECT   18    5    5                                                 
CONECT   19   21    8    7                                            
CONECT   20   30   30                                                 
CONECT   21   23   23   19                                            
CONECT   22   12   13                                                 
CONECT   23   21   21    6                                            
CONECT   24   11   14                                                 
CONECT   25   29   30   57                                            
CONECT   26   32   15                                                 
CONECT   27   33   58                                                 
CONECT   28   33   59                                                 
CONECT   29    8   25   60   61                                       
CONECT   30   25    9   20   20                                       
CONECT   31   10   10   32   62                                       
CONECT   32   31   26   11   11                                       
CONECT   33   17   28   27   63                                       
CONECT   34    1                                                      
CONECT   35    1                                                      
CONECT   36    2                                                      
CONECT   37    3                                                      
CONECT   38    3                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    4                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45    8                                                      
CONECT   46   10                                                      
CONECT   47   13                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   15                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   16                                                      
CONECT   57   25                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   29                                                      
CONECT   62   31                                                      
CONECT   63   33   64                                                 
CONECT   64   63                                                      
CONECT   65   17                                                      
MASTER        0    0    0    0    0    0    0    0   65    0   65    0
END
