COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.801  -0.131  -0.864  1.00  0.00           C  
HETATM    2  C   UNL     1      -3.234   0.062  -0.363  1.00  0.00           C  
HETATM    3  C   UNL     1      -4.009  -1.248  -0.519  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.420  -1.058  -0.025  1.00  0.00           C  
HETATM    5  C   UNL     1      -6.407  -0.639  -0.898  1.00  0.00           C  
HETATM    6  C   UNL     1      -5.729  -1.309   1.299  1.00  0.00           C  
HETATM    7  C   UNL     1      -7.701  -0.465  -0.445  1.00  0.00           C  
HETATM    8  C   UNL     1      -7.023  -1.135   1.751  1.00  0.00           C  
HETATM    9  C   UNL     1      -8.009  -0.710   0.880  1.00  0.00           C  
HETATM   10  C   UNL     1      -1.037   1.159  -0.710  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.585   2.136  -0.245  1.00  0.00           O  
HETATM   12  C   UNL     1       1.678  -0.634  -0.379  1.00  0.00           C  
HETATM   13  O   UNL     1       1.326  -0.362   0.749  1.00  0.00           O  
HETATM   14  C   UNL     1       1.074   0.093  -1.554  1.00  0.00           C  
HETATM   15  C   UNL     1       2.186   0.736  -2.419  1.00  0.00           C  
HETATM   16  C   UNL     1       2.473   2.044  -1.636  1.00  0.00           C  
HETATM   17  C   UNL     1       1.079   2.444  -1.108  1.00  0.00           C  
HETATM   18  C   UNL     1       1.202   3.011   0.308  1.00  0.00           C  
HETATM   19  C   UNL     1       2.273   4.104   0.328  1.00  0.00           C  
HETATM   20  C   UNL     1      -0.140   3.605   0.738  1.00  0.00           C  
HETATM   21  C   UNL     1       1.598   1.892   1.273  1.00  0.00           C  
HETATM   22  N   UNL     1       0.255   1.227  -1.089  1.00  0.00           N  
HETATM   23  C   UNL     1       4.071  -1.433   1.385  1.00  0.00           C  
HETATM   24  O   UNL     1       4.665  -0.391   0.608  1.00  0.00           O  
HETATM   25  C   UNL     1       3.129  -0.822   2.424  1.00  0.00           C  
HETATM   26  O   UNL     1       3.896  -0.159   3.431  1.00  0.00           O  
HETATM   27  C   UNL     1       3.280  -2.367   0.467  1.00  0.00           C  
HETATM   28  C   UNL     1       4.241  -3.349  -0.236  1.00  0.00           C  
HETATM   29  C   UNL     1       3.643  -3.459  -1.663  1.00  0.00           C  
HETATM   30  C   UNL     1       3.125  -2.017  -1.895  1.00  0.00           C  
HETATM   31  N   UNL     1       2.610  -1.586  -0.583  1.00  0.00           N  
HETATM   32  H   UNL     1      -1.314  -0.913  -0.281  1.00  0.00           H  
HETATM   33  H   UNL     1      -1.819  -0.419  -1.915  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.215   0.350   0.688  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.720   0.844  -0.945  1.00  0.00           H  
HETATM   36  H   UNL     1      -4.027  -1.536  -1.570  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.522  -2.030   0.064  1.00  0.00           H  
HETATM   38  H   UNL     1      -6.167  -0.447  -1.933  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.959  -1.640   1.979  1.00  0.00           H  
HETATM   40  H   UNL     1      -8.472  -0.137  -1.126  1.00  0.00           H  
HETATM   41  H   UNL     1      -7.264  -1.327   2.787  1.00  0.00           H  
HETATM   42  H   UNL     1      -9.020  -0.574   1.234  1.00  0.00           H  
HETATM   43  H   UNL     1       0.474  -0.591  -2.154  1.00  0.00           H  
HETATM   44  H   UNL     1       3.071   0.100  -2.455  1.00  0.00           H  
HETATM   45  H   UNL     1       1.823   0.953  -3.424  1.00  0.00           H  
HETATM   46  H   UNL     1       3.159   1.857  -0.811  1.00  0.00           H  
HETATM   47  H   UNL     1       2.868   2.813  -2.301  1.00  0.00           H  
HETATM   48  H   UNL     1       0.632   3.187  -1.768  1.00  0.00           H  
HETATM   49  H   UNL     1       1.991   4.901  -0.360  1.00  0.00           H  
HETATM   50  H   UNL     1       2.361   4.508   1.336  1.00  0.00           H  
HETATM   51  H   UNL     1       3.230   3.681   0.021  1.00  0.00           H  
HETATM   52  H   UNL     1      -0.790   2.809   1.101  1.00  0.00           H  
HETATM   53  H   UNL     1       0.022   4.332   1.533  1.00  0.00           H  
HETATM   54  H   UNL     1      -0.610   4.097  -0.115  1.00  0.00           H  
HETATM   55  H   UNL     1       2.431   1.328   0.854  1.00  0.00           H  
HETATM   56  H   UNL     1       1.896   2.325   2.228  1.00  0.00           H  
HETATM   57  H   UNL     1       0.748   1.227   1.426  1.00  0.00           H  
HETATM   58  H   UNL     1       4.853  -1.999   1.892  1.00  0.00           H  
HETATM   59  H   UNL     1       4.026   0.154   0.128  1.00  0.00           H  
HETATM   60  H   UNL     1       2.470  -0.102   1.938  1.00  0.00           H  
HETATM   61  H   UNL     1       2.532  -1.610   2.882  1.00  0.00           H  
HETATM   62  H   UNL     1       3.363   0.253   4.124  1.00  0.00           H  
HETATM   63  H   UNL     1       2.543  -2.921   1.048  1.00  0.00           H  
HETATM   64  H   UNL     1       5.251  -2.942  -0.271  1.00  0.00           H  
HETATM   65  H   UNL     1       4.232  -4.319   0.261  1.00  0.00           H  
HETATM   66  H   UNL     1       4.412  -3.719  -2.391  1.00  0.00           H  
HETATM   67  H   UNL     1       2.823  -4.177  -1.690  1.00  0.00           H  
HETATM   68  H   UNL     1       3.940  -1.368  -2.215  1.00  0.00           H  
HETATM   69  H   UNL     1       2.325  -2.016  -2.636  1.00  0.00           H  
CONECT    1   10    2   32   33                                       
CONECT    2    1    3   34   35                                       
CONECT    3    2    4   36   37                                       
CONECT    4    3    5    6    6                                       
CONECT    5    4    7    7   38                                       
CONECT    6    8    4    4   39                                       
CONECT    7    5    5    9   40                                       
CONECT    8    9    9    6   41                                       
CONECT    9    8    8    7   42                                       
CONECT   10   22   11   11    1                                       
CONECT   11   10   10                                                 
CONECT   12   31   13   13   14                                       
CONECT   13   12   12                                                 
CONECT   14   12   15   22   43                                       
CONECT   15   14   16   44   45                                       
CONECT   16   15   17   46   47                                       
CONECT   17   16   18   22   48                                       
CONECT   18   17   19   20   21                                       
CONECT   19   18   49   50   51                                       
CONECT   20   18   52   53   54                                       
CONECT   21   18   55   56   57                                       
CONECT   22   14   17   10                                            
CONECT   23   24   25   27   58                                       
CONECT   24   23   59                                                 
CONECT   25   23   26   60   61                                       
CONECT   26   25   62                                                 
CONECT   27   23   28   31   63                                       
CONECT   28   27   29   64   65                                       
CONECT   29   28   30   66   67                                       
CONECT   30   29   31   68   69                                       
CONECT   31   27   30   12                                            
CONECT   32    1                                                      
CONECT   33    1                                                      
CONECT   34    2                                                      
CONECT   35    2                                                      
CONECT   36    3                                                      
CONECT   37    3                                                      
CONECT   38    5                                                      
CONECT   39    6                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43   14                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   16                                                      
CONECT   47   16                                                      
CONECT   48   17                                                      
CONECT   49   19                                                      
CONECT   50   19                                                      
CONECT   51   19                                                      
CONECT   52   20                                                      
CONECT   53   20                                                      
CONECT   54   20                                                      
CONECT   55   21                                                      
CONECT   56   21                                                      
CONECT   57   21                                                      
CONECT   58   23                                                      
CONECT   59   24                                                      
CONECT   60   25                                                      
CONECT   61   25                                                      
CONECT   62   26                                                      
CONECT   63   27                                                      
CONECT   64   28                                                      
CONECT   65   28                                                      
CONECT   66   29                                                      
CONECT   67   29                                                      
CONECT   68   30                                                      
CONECT   69   30                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
