COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.587   3.755   0.022  1.00  0.00           C  
HETATM    2  N   UNL     1      -0.955  -1.872  -0.009  1.00  0.00           N  
HETATM    3  O   UNL     1      -6.705   2.865   0.034  1.00  0.00           O  
HETATM    4  C   UNL     1      -6.434   1.533   0.034  1.00  0.00           C  
HETATM    5  N   UNL     1      -5.642  -2.526   0.036  1.00  0.00           N  
HETATM    6  O   UNL     1      -8.770   1.050   0.058  1.00  0.00           O  
HETATM    7  C   UNL     1      -5.126   1.099   0.022  1.00  0.00           C  
HETATM    8  N   UNL     1      -1.777  -4.066   0.004  1.00  0.00           N  
HETATM    9  O   UNL     1       3.746   0.086  -0.054  1.00  0.00           O  
HETATM   10  C   UNL     1      -4.849  -0.268   0.022  1.00  0.00           C  
HETATM   11  N   UNL     1       1.060   2.469  -0.038  1.00  0.00           N  
HETATM   12  C   UNL     1      -3.478  -0.779   0.010  1.00  0.00           C  
HETATM   13  N   UNL     1       6.284  -0.479  -1.330  1.00  0.00           N  
HETATM   14  C   UNL     1      -2.354   0.044  -0.001  1.00  0.00           C  
HETATM   15  C   UNL     1      -1.098  -0.548  -0.011  1.00  0.00           C  
HETATM   16  C   UNL     1      -1.986  -2.698   0.001  1.00  0.00           C  
HETATM   17  C   UNL     1      -3.298  -2.186   0.012  1.00  0.00           C  
HETATM   18  C   UNL     1      -4.433  -3.017   0.025  1.00  0.00           C  
HETATM   19  C   UNL     1      -5.907  -1.208   0.035  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.230  -0.745   0.047  1.00  0.00           C  
HETATM   21  C   UNL     1      -7.485   0.608   0.046  1.00  0.00           C  
HETATM   22  C   UNL     1      -9.798   0.057   0.070  1.00  0.00           C  
HETATM   23  C   UNL     1       0.110   0.312  -0.024  1.00  0.00           C  
HETATM   24  C   UNL     1       1.386  -0.257  -0.033  1.00  0.00           C  
HETATM   25  C   UNL     1       2.485   0.593  -0.045  1.00  0.00           C  
HETATM   26  C   UNL     1       2.279   1.966  -0.047  1.00  0.00           C  
HETATM   27  C   UNL     1      -0.010   1.701  -0.026  1.00  0.00           C  
HETATM   28  C   UNL     1       4.823   1.026  -0.067  1.00  0.00           C  
HETATM   29  C   UNL     1       6.155   0.275  -0.076  1.00  0.00           C  
HETATM   30  C   UNL     1       7.306   1.277   0.037  1.00  0.00           C  
HETATM   31  C   UNL     1       8.611   0.532   0.152  1.00  0.00           C  
HETATM   32  C   UNL     1       9.319   0.199  -0.988  1.00  0.00           C  
HETATM   33  C   UNL     1      10.517  -0.485  -0.882  1.00  0.00           C  
HETATM   34  C   UNL     1      11.006  -0.834   0.362  1.00  0.00           C  
HETATM   35  C   UNL     1      10.298  -0.500   1.502  1.00  0.00           C  
HETATM   36  C   UNL     1       9.103   0.187   1.397  1.00  0.00           C  
HETATM   37  H   UNL     1      -5.943   4.785   0.023  1.00  0.00           H  
HETATM   38  H   UNL     1      -4.974   3.581   0.906  1.00  0.00           H  
HETATM   39  H   UNL     1      -4.991   3.577  -0.874  1.00  0.00           H  
HETATM   40  H   UNL     1      -4.317   1.816   0.012  1.00  0.00           H  
HETATM   41  H   UNL     1      -0.873  -4.418  -0.003  1.00  0.00           H  
HETATM   42  H   UNL     1      -2.534  -4.672   0.011  1.00  0.00           H  
HETATM   43  H   UNL     1       6.255   0.138  -2.127  1.00  0.00           H  
HETATM   44  H   UNL     1       7.126  -1.035  -1.333  1.00  0.00           H  
HETATM   45  H   UNL     1      -2.457   1.119  -0.003  1.00  0.00           H  
HETATM   46  H   UNL     1      -4.300  -4.089   0.027  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.049  -1.449   0.057  1.00  0.00           H  
HETATM   48  H   UNL     1     -10.773   0.544   0.078  1.00  0.00           H  
HETATM   49  H   UNL     1      -9.711  -0.567  -0.820  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.693  -0.563   0.960  1.00  0.00           H  
HETATM   51  H   UNL     1       1.515  -1.329  -0.031  1.00  0.00           H  
HETATM   52  H   UNL     1       3.129   2.631  -0.057  1.00  0.00           H  
HETATM   53  H   UNL     1      -0.991   2.152  -0.020  1.00  0.00           H  
HETATM   54  H   UNL     1       4.751   1.649  -0.958  1.00  0.00           H  
HETATM   55  H   UNL     1       4.766   1.655   0.822  1.00  0.00           H  
HETATM   56  H   UNL     1       6.190  -0.414   0.768  1.00  0.00           H  
HETATM   57  H   UNL     1       7.326   1.909  -0.850  1.00  0.00           H  
HETATM   58  H   UNL     1       7.163   1.897   0.922  1.00  0.00           H  
HETATM   59  H   UNL     1       8.937   0.472  -1.960  1.00  0.00           H  
HETATM   60  H   UNL     1      11.069  -0.746  -1.773  1.00  0.00           H  
HETATM   61  H   UNL     1      11.941  -1.369   0.444  1.00  0.00           H  
HETATM   62  H   UNL     1      10.680  -0.774   2.474  1.00  0.00           H  
HETATM   63  H   UNL     1       8.552   0.451   2.287  1.00  0.00           H  
CONECT    1    3   37   38   39                                       
CONECT    2   15   15   16                                            
CONECT    3    1    4                                                 
CONECT    4    3    7    7   21                                       
CONECT    5   18   18   19                                            
CONECT    6   21   22                                                 
CONECT    7    4    4   10   40                                       
CONECT    8   16   41   42                                            
CONECT    9   25   28                                                 
CONECT   10    7   12   19   19                                       
CONECT   11   26   26   27                                            
CONECT   12   10   14   14   17                                       
CONECT   13   29   43   44                                            
CONECT   14   12   12   15   45                                       
CONECT   15    2    2   14   23                                       
CONECT   16    2    8   17   17                                       
CONECT   17   12   16   16   18                                       
CONECT   18    5    5   17   46                                       
CONECT   19    5   10   10   20                                       
CONECT   20   19   21   21   47                                       
CONECT   21    4    6   20   20                                       
CONECT   22    6   48   49   50                                       
CONECT   23   15   24   27   27                                       
CONECT   24   23   25   25   51                                       
CONECT   25    9   24   24   26                                       
CONECT   26   11   11   25   52                                       
CONECT   27   11   23   23   53                                       
CONECT   28    9   29   54   55                                       
CONECT   29   13   28   30   56                                       
CONECT   30   29   31   57   58                                       
CONECT   31   30   32   32   36                                       
CONECT   32   31   31   33   59                                       
CONECT   33   32   34   34   60                                       
CONECT   34   33   33   35   61                                       
CONECT   35   34   36   36   62                                       
CONECT   36   31   35   35   63                                       
CONECT   37    1                                                      
CONECT   38    1                                                      
CONECT   39    1                                                      
CONECT   40    7                                                      
CONECT   41    8                                                      
CONECT   42    8                                                      
CONECT   43   13                                                      
CONECT   44   13                                                      
CONECT   45   14                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   26                                                      
CONECT   53   27                                                      
CONECT   54   28                                                      
CONECT   55   28                                                      
CONECT   56   29                                                      
CONECT   57   30                                                      
CONECT   58   30                                                      
CONECT   59   32                                                      
CONECT   60   33                                                      
CONECT   61   34                                                      
CONECT   62   35                                                      
CONECT   63   36                                                      
MASTER        0    0    0    0    0    0    0    0   63    0   63    0
END
