COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1       5.895   1.983  -0.090  1.00  0.00           N  
HETATM    2  N   UNL     1       0.099  -4.463  -0.058  1.00  0.00           N  
HETATM    3  C   UNL     1       3.495   1.948   0.042  1.00  0.00           C  
HETATM    4  C   UNL     1       2.318   1.229   0.074  1.00  0.00           C  
HETATM    5  C   UNL     1       2.389  -0.168   0.007  1.00  0.00           C  
HETATM    6  C   UNL     1       3.636  -0.779  -0.089  1.00  0.00           C  
HETATM    7  C   UNL     1       1.153  -0.985   0.040  1.00  0.00           C  
HETATM    8  C   UNL     1       0.075  -3.129   0.003  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.168  -2.451   0.102  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.366   1.114   0.331  1.00  0.00           C  
HETATM   11  C   UNL     1      -3.803   3.138   0.629  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.561   1.276  -0.853  1.00  0.00           C  
HETATM   13  C   UNL     1       7.164   1.286  -0.309  1.00  0.00           C  
HETATM   14  C   UNL     1       5.879   3.437   0.087  1.00  0.00           C  
HETATM   15  C   UNL     1       4.706   1.267  -0.056  1.00  0.00           C  
HETATM   16  N   UNL     1       4.738  -0.056  -0.118  1.00  0.00           N  
HETATM   17  N   UNL     1      -0.030  -0.374   0.133  1.00  0.00           N  
HETATM   18  C   UNL     1      -1.168  -1.036   0.167  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.300  -3.154   0.134  1.00  0.00           N  
HETATM   20  C   UNL     1      -2.253  -4.466   0.072  1.00  0.00           C  
HETATM   21  C   UNL     1      -1.032  -5.134  -0.026  1.00  0.00           C  
HETATM   22  C   UNL     1       1.252  -2.362  -0.028  1.00  0.00           C  
HETATM   23  N   UNL     1      -2.365  -0.349   0.264  1.00  0.00           N  
HETATM   24  C   UNL     1      -3.806   1.619   0.434  1.00  0.00           C  
HETATM   25  N   UNL     1      -5.938   1.779  -0.763  1.00  0.00           N  
HETATM   26  C   UNL     1      -5.961   3.241  -0.623  1.00  0.00           C  
HETATM   27  C   UNL     1      -5.248   3.642   0.671  1.00  0.00           C  
HETATM   28  H   UNL     1       3.478   3.027   0.087  1.00  0.00           H  
HETATM   29  H   UNL     1       1.365   1.732   0.150  1.00  0.00           H  
HETATM   30  H   UNL     1       3.702  -1.855  -0.141  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.804   1.438   1.207  1.00  0.00           H  
HETATM   32  H   UNL     1      -1.902   1.519  -0.569  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.304   3.384   1.566  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.276   3.611  -0.199  1.00  0.00           H  
HETATM   35  H   UNL     1      -4.060   1.740  -1.702  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.578   0.194  -0.987  1.00  0.00           H  
HETATM   37  H   UNL     1       7.374   1.239  -1.378  1.00  0.00           H  
HETATM   38  H   UNL     1       7.966   1.824   0.196  1.00  0.00           H  
HETATM   39  H   UNL     1       7.097   0.275   0.093  1.00  0.00           H  
HETATM   40  H   UNL     1       5.453   3.681   1.060  1.00  0.00           H  
HETATM   41  H   UNL     1       6.897   3.822   0.030  1.00  0.00           H  
HETATM   42  H   UNL     1       5.275   3.892  -0.698  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.171  -5.035   0.097  1.00  0.00           H  
HETATM   44  H   UNL     1      -1.015  -6.213  -0.076  1.00  0.00           H  
HETATM   45  H   UNL     1       2.218  -2.841  -0.104  1.00  0.00           H  
HETATM   46  H   UNL     1      -3.203  -0.837   0.289  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.299   1.144   1.283  1.00  0.00           H  
HETATM   48  H   UNL     1      -6.484   1.483  -1.558  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.453   3.695  -1.473  1.00  0.00           H  
HETATM   50  H   UNL     1      -6.995   3.586  -0.590  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.764   3.199   1.523  1.00  0.00           H  
HETATM   52  H   UNL     1      -5.252   4.728   0.766  1.00  0.00           H  
CONECT    1   13   15   14                                            
CONECT    2    8    8   21                                            
CONECT    3    4    4   15   28                                       
CONECT    4    3    3    5   29                                       
CONECT    5    4    6    6    7                                       
CONECT    6    5    5   16   30                                       
CONECT    7    5   22   22   17                                       
CONECT    8   22    2    2    9                                       
CONECT    9    8   18   19   19                                       
CONECT   10   23   24   31   32                                       
CONECT   11   24   27   33   34                                       
CONECT   12   24   25   35   36                                       
CONECT   13    1   37   38   39                                       
CONECT   14    1   40   41   42                                       
CONECT   15    3    1   16   16                                       
CONECT   16   15   15    6                                            
CONECT   17    7   18   18                                            
CONECT   18   17   17    9   23                                       
CONECT   19    9    9   20                                            
CONECT   20   21   21   19   43                                       
CONECT   21    2   20   20   44                                       
CONECT   22    7    7    8   45                                       
CONECT   23   18   10   46                                            
CONECT   24   10   11   12   47                                       
CONECT   25   12   26   48                                            
CONECT   26   27   25   49   50                                       
CONECT   27   11   26   51   52                                       
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    6                                                      
CONECT   31   10                                                      
CONECT   32   10                                                      
CONECT   33   11                                                      
CONECT   34   11                                                      
CONECT   35   12                                                      
CONECT   36   12                                                      
CONECT   37   13                                                      
CONECT   38   13                                                      
CONECT   39   13                                                      
CONECT   40   14                                                      
CONECT   41   14                                                      
CONECT   42   14                                                      
CONECT   43   20                                                      
CONECT   44   21                                                      
CONECT   45   22                                                      
CONECT   46   23                                                      
CONECT   47   24                                                      
CONECT   48   25                                                      
CONECT   49   26                                                      
CONECT   50   26                                                      
CONECT   51   27                                                      
CONECT   52   27                                                      
MASTER        0    0    0    0    0    0    0    0   52    0   52    0
END
