COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -2.615   2.089  -0.951  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.486  -0.163  -0.062  1.00  0.00           C  
HETATM    3  C   UNL     1      -5.095  -2.505  -1.027  1.00  0.00           C  
HETATM    4  C   UNL     1       1.614  -0.983  -0.059  1.00  0.00           C  
HETATM    5  C   UNL     1       2.899  -0.468  -0.127  1.00  0.00           C  
HETATM    6  C   UNL     1       4.569  -1.861   0.794  1.00  0.00           C  
HETATM    7  C   UNL     1       4.952  -0.720   1.738  1.00  0.00           C  
HETATM    8  C   UNL     1       6.231  -1.511  -1.349  1.00  0.00           C  
HETATM    9  C   UNL     1       4.746   2.698   0.646  1.00  0.00           C  
HETATM   10  C   UNL     1       3.113   0.890   0.112  1.00  0.00           C  
HETATM   11  C   UNL     1       2.047   1.719   0.420  1.00  0.00           C  
HETATM   12  C   UNL     1       0.767   1.202   0.488  1.00  0.00           C  
HETATM   13  C   UNL     1       0.548  -0.148   0.249  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.830   0.114  -0.058  1.00  0.00           C  
HETATM   15  C   UNL     1      -3.913   1.637  -0.796  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.115   0.367  -0.249  1.00  0.00           C  
HETATM   17  C   UNL     1      -5.922  -1.413  -0.399  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.577   0.529   0.501  1.00  0.00           C  
HETATM   19  C   UNL     1      -6.556   1.944   1.021  1.00  0.00           C  
HETATM   20  C   UNL     1       3.555  -2.776   1.485  1.00  0.00           C  
HETATM   21  C   UNL     1       4.987  -0.627  -1.243  1.00  0.00           C  
HETATM   22  C   UNL     1       5.361   0.689  -0.611  1.00  0.00           C  
HETATM   23  N   UNL     1       4.417   1.407   0.036  1.00  0.00           N  
HETATM   24  N   UNL     1      -0.750  -0.668   0.317  1.00  0.00           N  
HETATM   25  N   UNL     1      -1.610   1.312  -0.579  1.00  0.00           N  
HETATM   26  N   UNL     1      -7.224  -1.493  -0.067  1.00  0.00           N  
HETATM   27  N   UNL     1      -7.611  -0.269   0.493  1.00  0.00           N  
HETATM   28  N   UNL     1      -3.056  -0.360   0.103  1.00  0.00           N  
HETATM   29  N   UNL     1       3.975  -1.306  -0.429  1.00  0.00           N  
HETATM   30  O   UNL     1       6.500   1.100  -0.682  1.00  0.00           O  
HETATM   31  H   UNL     1      -2.424   3.064  -1.375  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.637  -3.110  -0.245  1.00  0.00           H  
HETATM   33  H   UNL     1      -5.735  -3.134  -1.646  1.00  0.00           H  
HETATM   34  H   UNL     1      -4.316  -2.060  -1.646  1.00  0.00           H  
HETATM   35  H   UNL     1       1.441  -2.032  -0.249  1.00  0.00           H  
HETATM   36  H   UNL     1       5.460  -2.435   0.538  1.00  0.00           H  
HETATM   37  H   UNL     1       5.269  -1.132   2.697  1.00  0.00           H  
HETATM   38  H   UNL     1       5.769  -0.146   1.302  1.00  0.00           H  
HETATM   39  H   UNL     1       4.091  -0.069   1.890  1.00  0.00           H  
HETATM   40  H   UNL     1       6.717  -1.572  -0.375  1.00  0.00           H  
HETATM   41  H   UNL     1       5.940  -2.510  -1.673  1.00  0.00           H  
HETATM   42  H   UNL     1       6.922  -1.081  -2.074  1.00  0.00           H  
HETATM   43  H   UNL     1       5.068   2.542   1.676  1.00  0.00           H  
HETATM   44  H   UNL     1       5.550   3.172   0.082  1.00  0.00           H  
HETATM   45  H   UNL     1       3.866   3.341   0.633  1.00  0.00           H  
HETATM   46  H   UNL     1       2.217   2.770   0.606  1.00  0.00           H  
HETATM   47  H   UNL     1      -0.064   1.849   0.728  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.751   2.251  -1.091  1.00  0.00           H  
HETATM   49  H   UNL     1      -6.888   2.624   0.236  1.00  0.00           H  
HETATM   50  H   UNL     1      -7.222   2.026   1.879  1.00  0.00           H  
HETATM   51  H   UNL     1      -5.541   2.205   1.322  1.00  0.00           H  
HETATM   52  H   UNL     1       3.282  -3.589   0.812  1.00  0.00           H  
HETATM   53  H   UNL     1       3.996  -3.188   2.392  1.00  0.00           H  
HETATM   54  H   UNL     1       2.664  -2.202   1.741  1.00  0.00           H  
HETATM   55  H   UNL     1       4.585  -0.447  -2.241  1.00  0.00           H  
HETATM   56  H   UNL     1      -0.893  -1.576   0.628  1.00  0.00           H  
HETATM   57  H   UNL     1      -7.796  -2.267  -0.191  1.00  0.00           H  
CONECT    1   15   25   25   31                                       
CONECT    2   18   17   17   16                                       
CONECT    3   17   32   33   34                                       
CONECT    4    5    5   13   35                                       
CONECT    5   29    4    4   10                                       
CONECT    6    7   20   29   36                                       
CONECT    7    6   37   38   39                                       
CONECT    8   21   40   41   42                                       
CONECT    9   23   43   44   45                                       
CONECT   10    5   23   11   11                                       
CONECT   11   10   10   12   46                                       
CONECT   12   13   13   11   47                                       
CONECT   13    4   24   12   12                                       
CONECT   14   28   28   25   24                                       
CONECT   15   16   16    1   48                                       
CONECT   16    2   15   15   28                                       
CONECT   17   26    3    2    2                                       
CONECT   18   27   27   19    2                                       
CONECT   19   18   49   50   51                                       
CONECT   20    6   52   53   54                                       
CONECT   21   29   22    8   55                                       
CONECT   22   21   30   30   23                                       
CONECT   23   22   10    9                                            
CONECT   24   14   13   56                                            
CONECT   25    1    1   14                                            
CONECT   26   27   17   57                                            
CONECT   27   26   18   18                                            
CONECT   28   16   14   14                                            
CONECT   29    6   21    5                                            
CONECT   30   22   22                                                 
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    3                                                      
CONECT   35    4                                                      
CONECT   36    6                                                      
CONECT   37    7                                                      
CONECT   38    7                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43    9                                                      
CONECT   44    9                                                      
CONECT   45    9                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   15                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   24                                                      
CONECT   57   26                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
