COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       3.351   0.789  -0.070  1.00  0.00           C  
HETATM    2  C   UNL     1       3.466  -1.512  -0.006  1.00  0.00           C  
HETATM    3  C   UNL     1       2.063  -1.570  -0.001  1.00  0.00           C  
HETATM    4  C   UNL     1       1.345  -0.361  -0.028  1.00  0.00           C  
HETATM    5  C   UNL     1       2.793  -3.612   0.045  1.00  0.00           C  
HETATM    6  C   UNL     1       5.294  -3.262   0.031  1.00  0.00           C  
HETATM    7  C   UNL     1       5.555  -4.135  -1.199  1.00  0.00           C  
HETATM    8  CA  UNL     1       3.246   3.254  -0.151  1.00  0.00           C  
HETATM    9  C   UNL     1       4.358   3.993  -2.263  1.00  0.00           C  
HETATM   10  O   UNL     1       4.064   3.978   2.004  1.00  0.00           O  
HETATM   11  C   UNL     1       2.876   3.670   1.274  1.00  0.00           C  
HETATM   12  C   UNL     1       4.093   4.351  -0.799  1.00  0.00           C  
HETATM   13  N   UNL     1       4.012   2.005  -0.112  1.00  0.00           N  
HETATM   14  N   UNL     1       2.024   0.780  -0.067  1.00  0.00           N  
HETATM   15  N   UNL     1       3.899  -2.813   0.024  1.00  0.00           N  
HETATM   16  C   UNL     1       5.561  -4.076   1.299  1.00  0.00           C  
HETATM   17  N   UNL     1       1.717  -2.881   0.031  1.00  0.00           N  
HETATM   18  N   UNL     1       4.065  -0.325  -0.041  1.00  0.00           N  
HETATM   19  N   UNL     1      -0.038  -0.360  -0.024  1.00  0.00           N  
HETATM   20  C   UNL     1      -0.770   0.908  -0.052  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.252   0.634  -0.042  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.931   0.475  -1.237  1.00  0.00           C  
HETATM   23  C   UNL     1      -4.288   0.223  -1.233  1.00  0.00           C  
HETATM   24  C   UNL     1      -4.974   0.130  -0.024  1.00  0.00           C  
HETATM   25  C   UNL     1      -4.284   0.291   1.177  1.00  0.00           C  
HETATM   26  C   UNL     1      -2.926   0.536   1.162  1.00  0.00           C  
HETATM   27  C   UNL     1      -6.433  -0.140  -0.014  1.00  0.00           C  
HETATM   28  N   UNL     1      -7.082  -0.292  -1.161  1.00  0.00           N  
HETATM   29  C   UNL     1      -8.376  -0.533  -1.196  1.00  0.00           C  
HETATM   30  C   UNL     1      -9.110  -0.637  -0.028  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.471  -0.485   1.194  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.109  -0.238   1.200  1.00  0.00           C  
HETATM   33  H   UNL     1       2.809  -4.691   0.070  1.00  0.00           H  
HETATM   34  H   UNL     1       5.955  -2.396   0.009  1.00  0.00           H  
HETATM   35  H   UNL     1       5.364  -3.555  -2.102  1.00  0.00           H  
HETATM   36  H   UNL     1       6.592  -4.469  -1.194  1.00  0.00           H  
HETATM   37  H   UNL     1       4.893  -5.001  -1.177  1.00  0.00           H  
HETATM   38  HA  UNL     1       2.337   3.104  -0.734  1.00  0.00           H  
HETATM   39  H   UNL     1       3.410   3.905  -2.793  1.00  0.00           H  
HETATM   40  H   UNL     1       4.962   4.775  -2.724  1.00  0.00           H  
HETATM   41  H   UNL     1       4.893   3.044  -2.313  1.00  0.00           H  
HETATM   42  H   UNL     1       3.905   4.251   2.918  1.00  0.00           H  
HETATM   43  H1  UNL     1       2.232   4.549   1.240  1.00  0.00           H  
HETATM   44  H2  UNL     1       2.349   2.852   1.766  1.00  0.00           H  
HETATM   45  H   UNL     1       3.558   5.300  -0.748  1.00  0.00           H  
HETATM   46  H   UNL     1       5.041   4.439  -0.269  1.00  0.00           H  
HETATM   47  H   UNL     1       4.982   2.031  -0.115  1.00  0.00           H  
HETATM   48  H   UNL     1       4.900  -4.942   1.321  1.00  0.00           H  
HETATM   49  H   UNL     1       6.598  -4.410   1.304  1.00  0.00           H  
HETATM   50  H   UNL     1       5.375  -3.455   2.175  1.00  0.00           H  
HETATM   51  H   UNL     1      -0.524  -1.200  -0.003  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.504   1.500   0.823  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.509   1.459  -0.956  1.00  0.00           H  
HETATM   54  H   UNL     1      -2.399   0.548  -2.173  1.00  0.00           H  
HETATM   55  H   UNL     1      -4.818   0.099  -2.166  1.00  0.00           H  
HETATM   56  H   UNL     1      -4.811   0.220   2.117  1.00  0.00           H  
HETATM   57  H   UNL     1      -2.390   0.657   2.091  1.00  0.00           H  
HETATM   58  H   UNL     1      -8.871  -0.651  -2.148  1.00  0.00           H  
HETATM   59  H   UNL     1     -10.172  -0.835  -0.067  1.00  0.00           H  
HETATM   60  H   UNL     1      -9.023  -0.562   2.119  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.579  -0.118   2.134  1.00  0.00           H  
CONECT    1   13   18   18   14                                       
CONECT    2   18   15    3    3                                       
CONECT    3    2    2    4   17                                       
CONECT    4    3   14   14   19                                       
CONECT    5   15   17   17   33                                       
CONECT    6    7   15   16   34                                       
CONECT    7    6   35   36   37                                       
CONECT    8   12   11   13   38                                       
CONECT    9   12   39   40   41                                       
CONECT   10   11   42                                                 
CONECT   11    8   10   43   44                                       
CONECT   12    8    9   45   46                                       
CONECT   13    1    8   47                                            
CONECT   14    1    4    4                                            
CONECT   15    2    5    6                                            
CONECT   16    6   48   49   50                                       
CONECT   17    3    5    5                                            
CONECT   18    1    1    2                                            
CONECT   19    4   20   51                                            
CONECT   20   19   21   52   53                                       
CONECT   21   20   22   22   26                                       
CONECT   22   21   21   23   54                                       
CONECT   23   22   24   24   55                                       
CONECT   24   23   23   25   27                                       
CONECT   25   24   26   26   56                                       
CONECT   26   21   25   25   57                                       
CONECT   27   24   32   32   28                                       
CONECT   28   27   29   29                                            
CONECT   29   28   28   30   58                                       
CONECT   30   29   31   31   59                                       
CONECT   31   30   30   32   60                                       
CONECT   32   27   27   31   61                                       
CONECT   33    5                                                      
CONECT   34    6                                                      
CONECT   35    7                                                      
CONECT   36    7                                                      
CONECT   37    7                                                      
CONECT   38    8                                                      
CONECT   39    9                                                      
CONECT   40    9                                                      
CONECT   41    9                                                      
CONECT   42   10                                                      
CONECT   43   11                                                      
CONECT   44   11                                                      
CONECT   45   12                                                      
CONECT   46   12                                                      
CONECT   47   13                                                      
CONECT   48   16                                                      
CONECT   49   16                                                      
CONECT   50   16                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   22                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   31                                                      
CONECT   61   32                                                      
MASTER        0    0    0    0    0    0    0    0   61    0   61    0
END
