COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -3.002   1.418  -0.168  1.00  0.00           N  
HETATM    2  C   UNL     1      -1.823   2.112  -0.061  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.613   1.386   0.078  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.975   0.040  -0.132  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.639   0.067   0.102  1.00  0.00           N  
HETATM    6  C   UNL     1      -1.784  -0.608   0.002  1.00  0.00           C  
HETATM    7  N   UNL     1      -2.102   3.402  -0.116  1.00  0.00           N  
HETATM    8  C   UNL     1      -4.231  -0.729  -0.237  1.00  0.00           C  
HETATM    9  N   UNL     1       0.592   2.059   0.187  1.00  0.00           N  
HETATM   10  C   UNL     1      -3.998   2.336  -0.289  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.418   3.560  -0.254  1.00  0.00           C  
HETATM   12  C   UNL     1       4.178  -0.068   0.229  1.00  0.00           C  
HETATM   13  C   UNL     1      -4.671  -1.503   0.838  1.00  0.00           C  
HETATM   14  N   UNL     1       5.380  -0.784   0.246  1.00  0.00           N  
HETATM   15  C   UNL     1       1.795   1.343   0.204  1.00  0.00           C  
HETATM   16  C   UNL     1       3.126  -0.496  -0.570  1.00  0.00           C  
HETATM   17  C   UNL     1       4.035   1.067   1.016  1.00  0.00           C  
HETATM   18  C   UNL     1      -5.849  -2.222   0.731  1.00  0.00           C  
HETATM   19  C   UNL     1       1.938   0.207  -0.583  1.00  0.00           C  
HETATM   20  C   UNL     1       2.849   1.774   0.999  1.00  0.00           C  
HETATM   21  O   UNL     1      -6.281  -2.977   1.776  1.00  0.00           O  
HETATM   22  C   UNL     1      -4.987  -0.681  -1.411  1.00  0.00           C  
HETATM   23  O   UNL     1       7.405  -1.061  -1.802  1.00  0.00           O  
HETATM   24  C   UNL     1      -6.159  -1.401  -1.506  1.00  0.00           C  
HETATM   25  C   UNL     1       5.531  -1.981  -0.584  1.00  0.00           C  
HETATM   26  C   UNL     1       6.487  -0.336   1.095  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.591  -2.172  -0.442  1.00  0.00           C  
HETATM   28  C   UNL     1       6.084  -1.585  -1.954  1.00  0.00           C  
HETATM   29  C   UNL     1       6.372  -0.994   2.472  1.00  0.00           C  
HETATM   30  H   UNL     1      -1.768  -1.687   0.030  1.00  0.00           H  
HETATM   31  H   UNL     1       0.603   3.027   0.252  1.00  0.00           H  
HETATM   32  H   UNL     1      -5.052   2.128  -0.393  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.936   4.505  -0.326  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.093  -1.542   1.750  1.00  0.00           H  
HETATM   35  H   UNL     1       3.238  -1.379  -1.182  1.00  0.00           H  
HETATM   36  H   UNL     1       4.851   1.398   1.641  1.00  0.00           H  
HETATM   37  H   UNL     1       1.120  -0.126  -1.204  1.00  0.00           H  
HETATM   38  H   UNL     1       2.737   2.657   1.611  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.857  -2.503   2.392  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.653  -0.080  -2.244  1.00  0.00           H  
HETATM   41  H   UNL     1       7.819  -0.789  -2.633  1.00  0.00           H  
HETATM   42  H   UNL     1      -6.742  -1.363  -2.414  1.00  0.00           H  
HETATM   43  H   UNL     1       6.220  -2.674  -0.101  1.00  0.00           H  
HETATM   44  H   UNL     1       4.561  -2.462  -0.709  1.00  0.00           H  
HETATM   45  H   UNL     1       7.435  -0.619   0.636  1.00  0.00           H  
HETATM   46  H   UNL     1       6.446   0.747   1.205  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.509  -2.734  -0.522  1.00  0.00           H  
HETATM   48  H   UNL     1       5.442  -0.825  -2.400  1.00  0.00           H  
HETATM   49  H   UNL     1       6.114  -2.461  -2.602  1.00  0.00           H  
HETATM   50  H   UNL     1       7.196  -0.661   3.103  1.00  0.00           H  
HETATM   51  H   UNL     1       5.425  -0.711   2.931  1.00  0.00           H  
HETATM   52  H   UNL     1       6.414  -2.077   2.362  1.00  0.00           H  
CONECT    1    4   10    2                                            
CONECT    2    1    3    7    7                                       
CONECT    3    5    5    2    9                                       
CONECT    4    8    6    6    1                                       
CONECT    5    6    3    3                                            
CONECT    6    4    4    5   30                                       
CONECT    7    2    2   11                                            
CONECT    8   22    4   13   13                                       
CONECT    9    3   15   31                                            
CONECT   10    1   11   11   32                                       
CONECT   11   10   10    7   33                                       
CONECT   12   16   14   17   17                                       
CONECT   13    8    8   18   34                                       
CONECT   14   26   12   25                                            
CONECT   15   19    9   20   20                                       
CONECT   16   19   19   12   35                                       
CONECT   17   12   12   20   36                                       
CONECT   18   27   27   13   21                                       
CONECT   19   16   16   15   37                                       
CONECT   20   15   15   17   38                                       
CONECT   21   18   39                                                 
CONECT   22   24   24    8   40                                       
CONECT   23   28   41                                                 
CONECT   24   22   22   27   42                                       
CONECT   25   14   28   43   44                                       
CONECT   26   29   14   45   46                                       
CONECT   27   24   18   18   47                                       
CONECT   28   25   23   48   49                                       
CONECT   29   26   50   51   52                                       
CONECT   30    6                                                      
CONECT   31    9                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   13                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   19                                                      
CONECT   38   20                                                      
CONECT   39   21                                                      
CONECT   40   22                                                      
CONECT   41   23                                                      
CONECT   42   24                                                      
CONECT   43   25                                                      
CONECT   44   25                                                      
CONECT   45   26                                                      
CONECT   46   26                                                      
CONECT   47   27                                                      
CONECT   48   28                                                      
CONECT   49   28                                                      
CONECT   50   29                                                      
CONECT   51   29                                                      
CONECT   52   29                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
