COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       3.274   4.211   0.356  1.00  0.00           N  
HETATM    2  C   UNL     1       4.716   1.311   0.073  1.00  0.00           C  
HETATM    3  C   UNL     1       3.549   1.908  -0.367  1.00  0.00           C  
HETATM    4  C   UNL     1       3.559   3.351  -0.800  1.00  0.00           C  
HETATM    5  C   UNL     1       2.373   1.183  -0.410  1.00  0.00           C  
HETATM    6  C   UNL     1       2.362  -0.144  -0.013  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.155  -1.135  -0.496  1.00  0.00           C  
HETATM    8  C   UNL     1      -5.511  -0.020  -0.594  1.00  0.00           C  
HETATM    9  C   UNL     1      -7.073   1.436   0.488  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.676  -0.005   1.795  1.00  0.00           C  
HETATM   11  N   UNL     1       6.561  -1.464  -0.144  1.00  0.00           N  
HETATM   12  C   UNL     1       3.793  -3.028  -0.185  1.00  0.00           C  
HETATM   13  O   UNL     1       3.530  -2.047   0.821  1.00  0.00           O  
HETATM   14  C   UNL     1       3.536  -0.745   0.430  1.00  0.00           C  
HETATM   15  C   UNL     1      -2.404  -0.405  -0.994  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.717  -0.735  -1.665  1.00  0.00           C  
HETATM   17  C   UNL     1      -6.495   0.946  -0.669  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.665   0.958   1.720  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.102  -0.499   0.640  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.030  -1.540   0.413  1.00  0.00           C  
HETATM   21  C   UNL     1       4.712  -0.013   0.471  1.00  0.00           C  
HETATM   22  C   UNL     1       5.987  -0.661   0.944  1.00  0.00           C  
HETATM   23  C   UNL     1       0.038  -0.177  -0.519  1.00  0.00           C  
HETATM   24  N   UNL     1      -3.550  -1.324  -0.971  1.00  0.00           N  
HETATM   25  O   UNL     1       1.205  -0.859  -0.054  1.00  0.00           O  
HETATM   26  H   UNL     1       3.275   5.185   0.091  1.00  0.00           H  
HETATM   27  H   UNL     1       2.399   3.956   0.789  1.00  0.00           H  
HETATM   28  H   UNL     1       5.634   1.879   0.101  1.00  0.00           H  
HETATM   29  H   UNL     1       2.799   3.506  -1.565  1.00  0.00           H  
HETATM   30  H   UNL     1       4.540   3.601  -1.206  1.00  0.00           H  
HETATM   31  H   UNL     1       1.462   1.651  -0.754  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.320  -1.484   0.523  1.00  0.00           H  
HETATM   33  H   UNL     1      -0.950  -1.987  -1.144  1.00  0.00           H  
HETATM   34  H   UNL     1      -7.845   2.188   0.430  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.358  -0.378   2.758  1.00  0.00           H  
HETATM   36  H   UNL     1       6.710  -0.901  -0.969  1.00  0.00           H  
HETATM   37  H   UNL     1       7.418  -1.910   0.148  1.00  0.00           H  
HETATM   38  H   UNL     1       3.759  -4.023   0.260  1.00  0.00           H  
HETATM   39  H   UNL     1       3.041  -2.954  -0.970  1.00  0.00           H  
HETATM   40  H   UNL     1       4.781  -2.855  -0.612  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.610   0.447  -0.346  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.239  -0.055  -2.013  1.00  0.00           H  
HETATM   43  H   UNL     1      -5.321  -1.520  -2.120  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.386  -0.026  -2.424  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.813   1.319  -1.631  1.00  0.00           H  
HETATM   46  H   UNL     1      -7.119   1.338   2.623  1.00  0.00           H  
HETATM   47  H   UNL     1      -3.214  -1.400   1.121  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.450  -2.541   0.515  1.00  0.00           H  
HETATM   49  H   UNL     1       5.773  -1.306   1.797  1.00  0.00           H  
HETATM   50  H   UNL     1       6.698   0.109   1.242  1.00  0.00           H  
HETATM   51  H   UNL     1       0.203   0.172  -1.538  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.167   0.675   0.128  1.00  0.00           H  
CONECT    1    4   26   27                                            
CONECT    2    3   21   21   28                                       
CONECT    3    4    5    5    2                                       
CONECT    4    1    3   29   30                                       
CONECT    5    3    3    6   31                                       
CONECT    6    5   25   14   14                                       
CONECT    7   23   15   32   33                                       
CONECT    8   16   17   17   19                                       
CONECT    9   17   18   18   34                                       
CONECT   10   19   19   18   35                                       
CONECT   11   22   36   37                                            
CONECT   12   13   38   39   40                                       
CONECT   13   12   14                                                 
CONECT   14    6    6   21   13                                       
CONECT   15    7   24   41   42                                       
CONECT   16    8   24   43   44                                       
CONECT   17    8    8    9   45                                       
CONECT   18    9    9   10   46                                       
CONECT   19    8   20   10   10                                       
CONECT   20   24   19   47   48                                       
CONECT   21    2    2   14   22                                       
CONECT   22   21   11   49   50                                       
CONECT   23   25    7   51   52                                       
CONECT   24   16   15   20                                            
CONECT   25    6   23                                                 
CONECT   26    1                                                      
CONECT   27    1                                                      
CONECT   28    2                                                      
CONECT   29    4                                                      
CONECT   30    4                                                      
CONECT   31    5                                                      
CONECT   32    7                                                      
CONECT   33    7                                                      
CONECT   34    9                                                      
CONECT   35   10                                                      
CONECT   36   11                                                      
CONECT   37   11                                                      
CONECT   38   12                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   15                                                      
CONECT   42   15                                                      
CONECT   43   16                                                      
CONECT   44   16                                                      
CONECT   45   17                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   20                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
