COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.104   2.415   0.376  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.330   3.336  -0.374  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.513   1.283  -0.166  1.00  0.00           C  
HETATM    4  C   UNL     1      -3.288   0.649  -0.125  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.227  -0.746   0.008  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.929  -1.423   0.053  1.00  0.00           C  
HETATM    7  C   UNL     1      -0.767  -0.684   0.099  1.00  0.00           C  
HETATM    8  C   UNL     1       0.597   1.002   0.240  1.00  0.00           C  
HETATM    9  C   UNL     1       2.802  -0.088   0.053  1.00  0.00           C  
HETATM   10  C   UNL     1       3.527   0.449   1.108  1.00  0.00           C  
HETATM   11  C   UNL     1       4.907   0.451   1.065  1.00  0.00           C  
HETATM   12  C   UNL     1       5.567  -0.081  -0.028  1.00  0.00           C  
HETATM   13  C   UNL     1       7.489  -0.842   1.071  1.00  0.00           C  
HETATM   14  C   UNL     1       7.419  -0.693  -1.322  1.00  0.00           C  
HETATM   15  C   UNL     1       7.453   1.306   0.004  1.00  0.00           C  
HETATM   16  C   UNL     1       4.848  -0.616  -1.081  1.00  0.00           C  
HETATM   17  C   UNL     1       3.467  -0.621  -1.043  1.00  0.00           C  
HETATM   18  C   UNL     1       0.613  -1.190  -0.001  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.412  -1.489   0.097  1.00  0.00           C  
HETATM   20  C   UNL     1      -5.633  -0.846   0.054  1.00  0.00           C  
HETATM   21  C   UNL     1      -6.653  -2.983   0.275  1.00  0.00           C  
HETATM   22  C   UNL     1      -5.689   0.540  -0.077  1.00  0.00           C  
HETATM   23  N   UNL     1      -0.657   0.672   0.241  1.00  0.00           N  
HETATM   24  N   UNL     1       1.401  -0.096   0.096  1.00  0.00           N  
HETATM   25  N   UNL     1       6.965  -0.078  -0.068  1.00  0.00           N1+
HETATM   26  O   UNL     1      -4.574   2.637  -0.288  1.00  0.00           O  
HETATM   27  O   UNL     1       0.968  -2.346  -0.140  1.00  0.00           O  
HETATM   28  O   UNL     1      -6.783  -1.567   0.141  1.00  0.00           O  
HETATM   29  O   UNL     1      -6.892   1.169  -0.117  1.00  0.00           O  
HETATM   30  H   UNL     1       0.260   3.105   0.382  1.00  0.00           H  
HETATM   31  H   UNL     1       1.660   2.513   1.308  1.00  0.00           H  
HETATM   32  H   UNL     1       1.758   2.649  -0.464  1.00  0.00           H  
HETATM   33  H   UNL     1      -2.777   2.988  -1.247  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.521   4.405  -0.468  1.00  0.00           H  
HETATM   35  H   UNL     1      -2.745   3.149   0.526  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.377   1.226  -0.194  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.883  -2.502   0.050  1.00  0.00           H  
HETATM   38  H   UNL     1       3.012   0.865   1.961  1.00  0.00           H  
HETATM   39  H   UNL     1       5.472   0.868   1.885  1.00  0.00           H  
HETATM   40  H   UNL     1       8.579  -0.840   1.039  1.00  0.00           H  
HETATM   41  H   UNL     1       7.152  -0.386   2.001  1.00  0.00           H  
HETATM   42  H   UNL     1       7.127  -1.869   1.018  1.00  0.00           H  
HETATM   43  H   UNL     1       7.057  -1.720  -1.375  1.00  0.00           H  
HETATM   44  H   UNL     1       7.030  -0.126  -2.168  1.00  0.00           H  
HETATM   45  H   UNL     1       8.509  -0.691  -1.354  1.00  0.00           H  
HETATM   46  H   UNL     1       8.543   1.308  -0.028  1.00  0.00           H  
HETATM   47  H   UNL     1       7.064   1.873  -0.842  1.00  0.00           H  
HETATM   48  H   UNL     1       7.116   1.762   0.934  1.00  0.00           H  
HETATM   49  H   UNL     1       5.366  -1.030  -1.933  1.00  0.00           H  
HETATM   50  H   UNL     1       2.905  -1.043  -1.863  1.00  0.00           H  
HETATM   51  H   UNL     1      -4.370  -2.564   0.199  1.00  0.00           H  
HETATM   52  H   UNL     1      -7.643  -3.435   0.333  1.00  0.00           H  
HETATM   53  H   UNL     1      -6.122  -3.382  -0.590  1.00  0.00           H  
HETATM   54  H   UNL     1      -6.094  -3.213   1.182  1.00  0.00           H  
HETATM   55  H   UNL     1      -7.255   1.267  -1.009  1.00  0.00           H  
CONECT    1    8   30   31   32                                       
CONECT    2   26   33   34   35                                       
CONECT    3    4   26   22   22                                       
CONECT    4    5    5    3   36                                       
CONECT    5    6    4    4   19                                       
CONECT    6    7    7    5   37                                       
CONECT    7   18    6    6   23                                       
CONECT    8   24    1   23   23                                       
CONECT    9   10   10   17   24                                       
CONECT   10   11    9    9   38                                       
CONECT   11   12   12   10   39                                       
CONECT   12   25   11   11   16                                       
CONECT   13   25   40   41   42                                       
CONECT   14   25   43   44   45                                       
CONECT   15   25   46   47   48                                       
CONECT   16   12   17   17   49                                       
CONECT   17   16   16    9   50                                       
CONECT   18   27   27   24    7                                       
CONECT   19    5   20   20   51                                       
CONECT   20   19   19   22   28                                       
CONECT   21   28   52   53   54                                       
CONECT   22    3    3   20   29                                       
CONECT   23    8    8    7                                            
CONECT   24    9   18    8                                            
CONECT   25   14   13   15   12                                       
CONECT   26    2    3                                                 
CONECT   27   18   18                                                 
CONECT   28   20   21                                                 
CONECT   29   22   55                                                 
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    1                                                      
CONECT   33    2                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    4                                                      
CONECT   37    6                                                      
CONECT   38   10                                                      
CONECT   39   11                                                      
CONECT   40   13                                                      
CONECT   41   13                                                      
CONECT   42   13                                                      
CONECT   43   14                                                      
CONECT   44   14                                                      
CONECT   45   14                                                      
CONECT   46   15                                                      
CONECT   47   15                                                      
CONECT   48   15                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   19                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   21                                                      
CONECT   55   29                                                      
MASTER        0    0    0    0    0    0    0    0   55    0   55    0
END
