COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.214   0.660  -0.442  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.367  -1.686  -0.240  1.00  0.00           C  
HETATM    3  O   UNL     1      -1.522   1.643  -0.630  1.00  0.00           O  
HETATM    4  C   UNL     1       2.009  -0.722   0.447  1.00  0.00           C  
HETATM    5  C   UNL     1       4.122  -0.194   0.064  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.832  -0.235   0.195  1.00  0.00           C  
HETATM    7  C   UNL     1      -6.422   1.041   0.191  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.652   2.149  -0.016  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.280   2.055  -0.223  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.660   0.814  -0.226  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.441  -0.344  -0.015  1.00  0.00           C  
HETATM   12  C   UNL     1      -3.819  -1.613  -0.017  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.594  -2.744   0.191  1.00  0.00           C  
HETATM   14  C   UNL     1      -5.963  -2.624   0.398  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.582  -1.406   0.403  1.00  0.00           C  
HETATM   16  N   UNL     1      -1.651  -0.563  -0.437  1.00  0.00           N  
HETATM   17  O   UNL     1      -1.810  -2.767  -0.245  1.00  0.00           O  
HETATM   18  C   UNL     1      -0.208  -0.677  -0.662  1.00  0.00           C  
HETATM   19  C   UNL     1       0.525  -0.605   0.679  1.00  0.00           C  
HETATM   20  N   UNL     1       2.851   0.327   0.229  1.00  0.00           N  
HETATM   21  C   UNL     1       3.990  -1.586   0.203  1.00  0.00           C  
HETATM   22  N   UNL     1       2.675  -1.839   0.432  1.00  0.00           N  
HETATM   23  C   UNL     1       5.368   0.363  -0.182  1.00  0.00           C  
HETATM   24  C   UNL     1       6.473  -0.453  -0.298  1.00  0.00           C  
HETATM   25  C   UNL     1       6.347  -1.829  -0.170  1.00  0.00           C  
HETATM   26  C   UNL     1       5.122  -2.398   0.093  1.00  0.00           C  
HETATM   27  C   UNL     1       2.496   1.679   0.181  1.00  0.00           C  
HETATM   28  C   UNL     1       2.970   2.576   1.135  1.00  0.00           C  
HETATM   29  C   UNL     1       2.597   3.902   1.053  1.00  0.00           C  
HETATM   30  N   UNL     1       1.803   4.322   0.086  1.00  0.00           N  
HETATM   31  C   UNL     1       1.334   3.503  -0.836  1.00  0.00           C  
HETATM   32  C   UNL     1       1.664   2.164  -0.826  1.00  0.00           C  
HETATM   33  C   UNL     1       7.566  -2.706  -0.300  1.00  0.00           C  
HETATM   34  H   UNL     1      -7.485   1.145   0.351  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.119   3.123  -0.017  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.697   2.950  -0.384  1.00  0.00           H  
HETATM   37  H   UNL     1      -4.133  -3.721   0.193  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.552  -3.514   0.558  1.00  0.00           H  
HETATM   39  H   UNL     1      -7.647  -1.343   0.566  1.00  0.00           H  
HETATM   40  H   UNL     1       0.010  -1.629  -1.145  1.00  0.00           H  
HETATM   41  H   UNL     1       0.125   0.140  -1.302  1.00  0.00           H  
HETATM   42  H   UNL     1       0.191  -1.422   1.319  1.00  0.00           H  
HETATM   43  H   UNL     1       0.306   0.347   1.162  1.00  0.00           H  
HETATM   44  H   UNL     1       5.473   1.433  -0.283  1.00  0.00           H  
HETATM   45  H   UNL     1       7.443  -0.019  -0.489  1.00  0.00           H  
HETATM   46  H   UNL     1       5.033  -3.469   0.199  1.00  0.00           H  
HETATM   47  H   UNL     1       3.620   2.239   1.929  1.00  0.00           H  
HETATM   48  H   UNL     1       2.959   4.605   1.789  1.00  0.00           H  
HETATM   49  H   UNL     1       0.686   3.887  -1.610  1.00  0.00           H  
HETATM   50  H   UNL     1       1.277   1.499  -1.584  1.00  0.00           H  
HETATM   51  H   UNL     1       8.024  -2.839   0.680  1.00  0.00           H  
HETATM   52  H   UNL     1       7.274  -3.678  -0.699  1.00  0.00           H  
HETATM   53  H   UNL     1       8.282  -2.237  -0.975  1.00  0.00           H  
CONECT    1   10    3    3   16                                       
CONECT    2   12   16   17   17                                       
CONECT    3    1    1                                                 
CONECT    4   19   22   22   20                                       
CONECT    5   21   20   23   23                                       
CONECT    6    7   15   15   11                                       
CONECT    7    8    8    6   34                                       
CONECT    8    7    7    9   35                                       
CONECT    9    8   10   10   36                                       
CONECT   10    9    9   11    1                                       
CONECT   11    6   10   12   12                                       
CONECT   12   11   11   13    2                                       
CONECT   13   14   14   12   37                                       
CONECT   14   15   13   13   38                                       
CONECT   15    6    6   14   39                                       
CONECT   16    1    2   18                                            
CONECT   17    2    2                                                 
CONECT   18   16   19   40   41                                       
CONECT   19   18    4   42   43                                       
CONECT   20    4    5   27                                            
CONECT   21   22   26   26    5                                       
CONECT   22    4    4   21                                            
CONECT   23    5    5   24   44                                       
CONECT   24   25   25   23   45                                       
CONECT   25   26   33   24   24                                       
CONECT   26   21   21   25   46                                       
CONECT   27   32   20   28   28                                       
CONECT   28   27   27   29   47                                       
CONECT   29   30   30   28   48                                       
CONECT   30   31   29   29                                            
CONECT   31   32   32   30   49                                       
CONECT   32   31   31   27   50                                       
CONECT   33   25   51   52   53                                       
CONECT   34    7                                                      
CONECT   35    8                                                      
CONECT   36    9                                                      
CONECT   37   13                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   18                                                      
CONECT   41   18                                                      
CONECT   42   19                                                      
CONECT   43   19                                                      
CONECT   44   23                                                      
CONECT   45   24                                                      
CONECT   46   26                                                      
CONECT   47   28                                                      
CONECT   48   29                                                      
CONECT   49   31                                                      
CONECT   50   32                                                      
CONECT   51   33                                                      
CONECT   52   33                                                      
CONECT   53   33                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
