COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -4.100   1.564  -0.389  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.949   0.519  -0.015  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.420  -0.650   0.491  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.052  -0.792   0.631  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.720   1.419  -0.247  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.200   0.240   0.263  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.039   1.197   0.004  1.00  0.00           C  
HETATM    8  C   UNL     1       6.103   0.207   2.207  1.00  0.00           C  
HETATM    9  C   UNL     1       1.411   0.856   0.230  1.00  0.00           C  
HETATM   10  C   UNL     1       2.002   1.150   1.456  1.00  0.00           C  
HETATM   11  C   UNL     1       3.309   0.848   1.692  1.00  0.00           C  
HETATM   12  C   UNL     1       2.122   0.259  -0.767  1.00  0.00           C  
HETATM   13  C   UNL     1       3.474  -0.063  -0.562  1.00  0.00           C  
HETATM   14  N   UNL     1       4.195  -0.650  -1.524  1.00  0.00           N  
HETATM   15  C   UNL     1       4.071   0.233   0.687  1.00  0.00           C  
HETATM   16  C   UNL     1       5.427  -0.095   0.895  1.00  0.00           C  
HETATM   17  C   UNL     1       6.110  -0.692  -0.121  1.00  0.00           C  
HETATM   18  C   UNL     1       5.463  -0.954  -1.338  1.00  0.00           C  
HETATM   19  N   UNL     1       6.171  -1.563  -2.364  1.00  0.00           N  
HETATM   20  N   UNL     1      -5.076   3.740  -1.342  1.00  0.00           N  
HETATM   21  C   UNL     1      -4.644   2.777  -0.920  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.337  -1.776   0.893  1.00  0.00           C  
HETATM   23  N   UNL     1      -5.559  -2.662  -0.257  1.00  0.00           N  
HETATM   24  C   UNL     1      -6.450  -3.774   0.099  1.00  0.00           C  
HETATM   25  O   UNL     1      -0.856   0.095   0.402  1.00  0.00           O  
HETATM   26  H   UNL     1      -6.018   0.627  -0.123  1.00  0.00           H  
HETATM   27  H   UNL     1      -2.644  -1.710   1.028  1.00  0.00           H  
HETATM   28  H   UNL     1      -2.058   2.223  -0.534  1.00  0.00           H  
HETATM   29  H   UNL     1      -0.302   2.076   0.594  1.00  0.00           H  
HETATM   30  H   UNL     1      -0.203   1.408  -1.053  1.00  0.00           H  
HETATM   31  H   UNL     1       6.544   1.203   2.168  1.00  0.00           H  
HETATM   32  H   UNL     1       5.369   0.166   3.012  1.00  0.00           H  
HETATM   33  H   UNL     1       6.886  -0.529   2.391  1.00  0.00           H  
HETATM   34  H   UNL     1       1.416   1.624   2.229  1.00  0.00           H  
HETATM   35  H   UNL     1       3.756   1.082   2.647  1.00  0.00           H  
HETATM   36  H   UNL     1       1.648   0.033  -1.710  1.00  0.00           H  
HETATM   37  H   UNL     1       7.149  -0.955   0.006  1.00  0.00           H  
HETATM   38  H   UNL     1       7.102  -1.802  -2.235  1.00  0.00           H  
HETATM   39  H   UNL     1       5.735  -1.750  -3.210  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.882  -2.343   1.706  1.00  0.00           H  
HETATM   41  H   UNL     1      -6.291  -1.367   1.225  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.683  -3.004  -0.624  1.00  0.00           H  
HETATM   43  H   UNL     1      -6.003  -4.355   0.906  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.412  -3.379   0.425  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.598  -4.415  -0.771  1.00  0.00           H  
CONECT    1   21    5    5    2                                       
CONECT    2    1    3    3   26                                       
CONECT    3    2    2    4   22                                       
CONECT    4    6    6    3   27                                       
CONECT    5    1    1    6   28                                       
CONECT    6    5   25    4    4                                       
CONECT    7    9   25   29   30                                       
CONECT    8   16   31   32   33                                       
CONECT    9   10   10   12    7                                       
CONECT   10   11    9    9   34                                       
CONECT   11   15   15   10   35                                       
CONECT   12   13   13    9   36                                       
CONECT   13   15   14   12   12                                       
CONECT   14   18   18   13                                            
CONECT   15   16   11   11   13                                       
CONECT   16    8   17   17   15                                       
CONECT   17   16   16   18   37                                       
CONECT   18   17   19   14   14                                       
CONECT   19   18   38   39                                            
CONECT   20   21   21   21                                            
CONECT   21   20   20   20    1                                       
CONECT   22    3   23   40   41                                       
CONECT   23   24   22   42                                            
CONECT   24   23   43   44   45                                       
CONECT   25    6    7                                                 
CONECT   26    2                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33    8                                                      
CONECT   34   10                                                      
CONECT   35   11                                                      
CONECT   36   12                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   19                                                      
CONECT   40   22                                                      
CONECT   41   22                                                      
CONECT   42   23                                                      
CONECT   43   24                                                      
CONECT   44   24                                                      
CONECT   45   24                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
