COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNK A   1      -4.160  -0.576  -0.612  1.00  0.00           N1+
HETATM    2  C   UNK A   1      -6.766  -1.025   0.094  1.00  0.00           C  
HETATM    3  C   UNK A   1      -4.421  -1.435   0.353  1.00  0.00           C  
HETATM    4  C   UNK A   1       1.780   3.690   0.650  1.00  0.00           C  
HETATM    5  N   UNK A   1       2.080   1.315   0.255  1.00  0.00           N  
HETATM    6  C   UNK A   1      -6.447  -0.129  -0.914  1.00  0.00           C  
HETATM    7  O   UNK A   0       3.587   1.823  -1.294  1.00  0.00           O  
HETATM    8  C   UNK A   1      -5.120   0.071  -1.244  1.00  0.00           C  
HETATM    9  C   UNK A   1      -8.201  -1.271   0.482  1.00  0.00           C  
HETATM   10  C   UNK A   1      -0.750   1.077  -0.540  1.00  0.00           C  
HETATM   11  C   UNK A   1      -2.206   0.819  -0.147  1.00  0.00           C  
HETATM   12  C   UNK A   1      -2.766  -0.329  -0.989  1.00  0.00           C  
HETATM   13  C   UNK A   0       3.227   1.073  -0.408  1.00  0.00           C  
HETATM   14  C   UNK A   1      -5.729  -1.690   0.739  1.00  0.00           C  
HETATM   15  C   UNK A   1       1.266   2.483  -0.091  1.00  0.00           C  
HETATM   16  C   UNK A   1      -0.190   2.225   0.303  1.00  0.00           C  
HETATM   17  O   UNK A   1      -9.059  -0.466  -0.329  1.00  0.00           O  
HETATM   18  O   UNK A   1       2.729   3.586   1.391  1.00  0.00           O  
HETATM   19  O   UNK A   1      -5.993  -2.577   1.735  1.00  0.00           O  
HETATM   20  O   UNK A   1       1.184   4.882   0.486  1.00  0.00           O  
HETATM   21  O   UNK A   0       3.975  -0.001  -0.090  1.00  0.00           O  
HETATM   22  H   UNK A   1      -3.608  -1.946   0.847  1.00  0.00           H  
HETATM   23  H   UNK A   1       1.792   0.716   0.962  1.00  0.00           H  
HETATM   24  H   UNK A   1      -7.227   0.406  -1.436  1.00  0.00           H  
HETATM   25  H   UNK A   1      -4.865   0.767  -2.030  1.00  0.00           H  
HETATM   26  H   UNK A   1      -8.442  -2.323   0.333  1.00  0.00           H  
HETATM   27  H   UNK A   1      -8.344  -1.010   1.531  1.00  0.00           H  
HETATM   28  H   UNK A   1      -0.161   0.177  -0.365  1.00  0.00           H  
HETATM   29  H   UNK A   1      -0.701   1.344  -1.596  1.00  0.00           H  
HETATM   30  H   UNK A   1      -2.255   0.552   0.909  1.00  0.00           H  
HETATM   31  H   UNK A   1      -2.795   1.719  -0.322  1.00  0.00           H  
HETATM   32  H   UNK A   1      -2.177  -1.229  -0.814  1.00  0.00           H  
HETATM   33  H   UNK A   1      -2.717  -0.062  -2.045  1.00  0.00           H  
HETATM   34  H   UNK A   1       1.326   2.662  -1.164  1.00  0.00           H  
HETATM   35  H   UNK A   1      -0.779   3.125   0.127  1.00  0.00           H  
HETATM   36  H   UNK A   1      -0.239   1.958   1.358  1.00  0.00           H  
HETATM   37  H   UNK A   1     -10.000  -0.574  -0.134  1.00  0.00           H  
HETATM   38  H   UNK A   1      -6.021  -2.181   2.617  1.00  0.00           H  
HETATM   39  H   UNK A   1       1.549   5.627   0.983  1.00  0.00           H  
HETATM   40  C   UNK A   0       5.199  -0.199  -0.846  1.00  0.00           C  
HETATM   41  C   UNK A   0       5.898  -1.440  -0.354  1.00  0.00           C  
HETATM   42  C   UNK A   0       5.617  -2.666  -0.929  1.00  0.00           C  
HETATM   43  C   UNK A   0       6.258  -3.804  -0.478  1.00  0.00           C  
HETATM   44  C   UNK A   0       7.181  -3.717   0.548  1.00  0.00           C  
HETATM   45  C   UNK A   0       7.462  -2.491   1.122  1.00  0.00           C  
HETATM   46  C   UNK A   0       6.824  -1.352   0.668  1.00  0.00           C  
HETATM   47  H   UNK A   0       4.958  -0.313  -1.904  1.00  0.00           H  
HETATM   48  H   UNK A   0       5.852   0.663  -0.713  1.00  0.00           H  
HETATM   49  H   UNK A   0       4.897  -2.734  -1.731  1.00  0.00           H  
HETATM   50  H   UNK A   0       6.039  -4.761  -0.927  1.00  0.00           H  
HETATM   51  H   UNK A   0       7.681  -4.607   0.901  1.00  0.00           H  
HETATM   52  H   UNK A   0       8.182  -2.424   1.924  1.00  0.00           H  
HETATM   53  H   UNK A   0       7.044  -0.395   1.117  1.00  0.00           H  
CONECT    1   12    8    8    3                                       
CONECT    2    6    6   14    9                                       
CONECT    3    1   14   14   22                                       
CONECT    4   18   18   20   15                                       
CONECT    5   15   13   23                                            
CONECT    6    8    2    2   24                                       
CONECT    7   13   13                                                 
CONECT    8    1    1    6   25                                       
CONECT    9    2   17   26   27                                       
CONECT   10   16   11   28   29                                       
CONECT   11   10   12   30   31                                       
CONECT   12   11    1   32   33                                       
CONECT   13    7    7    5   21                                       
CONECT   14    3    3    2   19                                       
CONECT   15    4   16    5   34                                       
CONECT   16   15   10   35   36                                       
CONECT   17    9   37                                                 
CONECT   18    4    4                                                 
CONECT   19   14   38                                                 
CONECT   20    4   39                                                 
CONECT   21   13   40                                                 
CONECT   22    3                                                      
CONECT   23    5                                                      
CONECT   24    6                                                      
CONECT   25    8                                                      
CONECT   26    9                                                      
CONECT   27    9                                                      
CONECT   28   10                                                      
CONECT   29   10                                                      
CONECT   30   11                                                      
CONECT   31   11                                                      
CONECT   32   12                                                      
CONECT   33   12                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   16                                                      
CONECT   37   17                                                      
CONECT   38   19                                                      
CONECT   39   20                                                      
CONECT   40   21   41   47   48                                       
CONECT   41   40   42   46   46                                       
CONECT   42   41   43   43   49                                       
CONECT   43   42   42   44   50                                       
CONECT   44   43   45   45   51                                       
CONECT   45   44   44   46   52                                       
CONECT   46   45   41   41   53                                       
CONECT   47   40                                                      
CONECT   48   40                                                      
CONECT   49   42                                                      
CONECT   50   43                                                      
CONECT   51   44                                                      
CONECT   52   45                                                      
CONECT   53   46                                                      
MASTER        0    0    0    0    0    0    0    0   53    0   53    0
END
