COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -1.760   1.688  -1.596  1.00  0.00           C  
HETATM    2  C   UNL     1      -2.613   2.769  -1.530  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.722   2.753  -0.691  1.00  0.00           C  
HETATM    4  C   UNL     1      -1.760  -1.789  -0.571  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.944   1.691   0.160  1.00  0.00           C  
HETATM    6  N   UNL     1      -2.864  -4.189   0.159  1.00  0.00           N  
HETATM    7  C   UNL     1      -1.722  -4.146  -0.545  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.910   3.075   2.021  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.967   1.741   1.262  1.00  0.00           C  
HETATM   10  C   UNL     1      -4.211  -0.622   1.711  1.00  0.00           C  
HETATM   11  O   UNL     1      -1.159  -5.183  -0.837  1.00  0.00           O  
HETATM   12  N   UNL     1      -1.184  -2.974  -0.939  1.00  0.00           N  
HETATM   13  C   UNL     1      -3.503  -3.053   0.511  1.00  0.00           C  
HETATM   14  O   UNL     1      -4.587  -3.133   1.061  1.00  0.00           O  
HETATM   15  C   UNL     1      -2.911  -1.805   0.211  1.00  0.00           C  
HETATM   16  N   UNL     1      -3.431  -0.623   0.682  1.00  0.00           N1+
HETATM   17  C   UNL     1      -4.706   0.657   2.312  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.373   1.537   0.692  1.00  0.00           C  
HETATM   19  C   UNL     1      -3.146   0.551   0.017  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.677   3.911  -0.861  1.00  0.00           C  
HETATM   21  C   UNL     1      -2.347   3.989  -2.376  1.00  0.00           C  
HETATM   22  C   UNL     1      -2.046   0.555  -0.856  1.00  0.00           C  
HETATM   23  N   UNL     1      -1.242  -0.582  -0.958  1.00  0.00           N  
HETATM   24  C   UNL     1       0.120  -0.492  -1.489  1.00  0.00           C  
HETATM   25  C   UNL     1       1.098  -0.225  -0.343  1.00  0.00           C  
HETATM   26  O   UNL     1       0.755   1.005   0.299  1.00  0.00           O  
HETATM   27  C   UNL     1       2.520  -0.132  -0.898  1.00  0.00           C  
HETATM   28  O   UNL     1       2.863  -1.362  -1.540  1.00  0.00           O  
HETATM   29  C   UNL     1       3.498   0.135   0.248  1.00  0.00           C  
HETATM   30  O   UNL     1       3.155   1.365   0.890  1.00  0.00           O  
HETATM   31  C   UNL     1       4.921   0.229  -0.307  1.00  0.00           C  
HETATM   32  O   UNL     1       5.846   0.362   0.774  1.00  0.00           O  
HETATM   33  P   UNL     1       7.437   0.487   0.557  1.00  0.00           P  
HETATM   34  O   UNL     1       7.722   1.614  -0.358  1.00  0.00           O  
HETATM   35  O   UNL     1       8.153   0.752   1.975  1.00  0.00           O  
HETATM   36  O   UNL     1       8.000  -0.880  -0.082  1.00  0.00           O  
HETATM   37  H   UNL     1      -0.900   1.740  -2.246  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.236  -5.046   0.420  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.238   3.881   1.365  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.564   3.026   2.892  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.886   3.265   2.346  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.483  -1.551   2.189  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.964   1.031   3.023  1.00  0.00           H  
HETATM   44  H   UNL     1      -5.635   0.464   2.853  1.00  0.00           H  
HETATM   45  H   UNL     1      -6.610   2.353   0.010  1.00  0.00           H  
HETATM   46  H   UNL     1      -6.413   0.590   0.153  1.00  0.00           H  
HETATM   47  H   UNL     1      -7.096   1.522   1.507  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.030   3.943  -1.892  1.00  0.00           H  
HETATM   49  H   UNL     1      -5.526   3.782  -0.190  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.164   4.843  -0.623  1.00  0.00           H  
HETATM   51  H   UNL     1      -2.921   3.922  -3.300  1.00  0.00           H  
HETATM   52  H   UNL     1      -2.644   4.883  -1.828  1.00  0.00           H  
HETATM   53  H   UNL     1      -1.284   4.043  -2.612  1.00  0.00           H  
HETATM   54  H   UNL     1       0.382  -1.430  -1.979  1.00  0.00           H  
HETATM   55  H   UNL     1       0.176   0.322  -2.211  1.00  0.00           H  
HETATM   56  H   UNL     1       1.042  -1.040   0.379  1.00  0.00           H  
HETATM   57  H   UNL     1       0.783   1.774  -0.286  1.00  0.00           H  
HETATM   58  H   UNL     1       2.576   0.683  -1.620  1.00  0.00           H  
HETATM   59  H   UNL     1       2.835  -2.131  -0.956  1.00  0.00           H  
HETATM   60  H   UNL     1       3.443  -0.679   0.970  1.00  0.00           H  
HETATM   61  H   UNL     1       3.184   2.135   0.306  1.00  0.00           H  
HETATM   62  H   UNL     1       5.151  -0.674  -0.873  1.00  0.00           H  
HETATM   63  H   UNL     1       5.000   1.097  -0.961  1.00  0.00           H  
HETATM   64  H   UNL     1       9.114   0.837   1.920  1.00  0.00           H  
HETATM   65  H   UNL     1       7.847  -1.662   0.466  1.00  0.00           H  
HETATM   66  H   UNL     1      -0.389  -3.003  -1.493  1.00  0.00           H  
CONECT    1    2   22   22   37                                       
CONECT    2   21    3    3    1                                       
CONECT    3   20    2    2    5                                       
CONECT    4   23   15   15   12                                       
CONECT    5    3    9   19   19                                       
CONECT    6   13    7   38                                            
CONECT    7   12    6   11   11                                       
CONECT    8    9   39   40   41                                       
CONECT    9   18    8    5   17                                       
CONECT   10   17   16   16   42                                       
CONECT   11    7    7                                                 
CONECT   12    4    7   66                                            
CONECT   13   15   14   14    6                                       
CONECT   14   13   13                                                 
CONECT   15   16    4    4   13                                       
CONECT   16   19   10   10   15                                       
CONECT   17    9   10   43   44                                       
CONECT   18    9   45   46   47                                       
CONECT   19    5    5   22   16                                       
CONECT   20    3   48   49   50                                       
CONECT   21    2   51   52   53                                       
CONECT   22    1    1   19   23                                       
CONECT   23   22   24    4                                            
CONECT   24   23   25   54   55                                       
CONECT   25   26   24   27   56                                       
CONECT   26   25   57                                                 
CONECT   27   25   29   28   58                                       
CONECT   28   27   59                                                 
CONECT   29   27   30   31   60                                       
CONECT   30   29   61                                                 
CONECT   31   29   32   62   63                                       
CONECT   32   31   33                                                 
CONECT   33   32   34   34   35                                       
CONECT   33   36                                                      
CONECT   34   33   33                                                 
CONECT   35   33   64                                                 
CONECT   36   33   65                                                 
CONECT   37    1                                                      
CONECT   38    6                                                      
CONECT   39    8                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42   10                                                      
CONECT   43   17                                                      
CONECT   44   17                                                      
CONECT   45   18                                                      
CONECT   46   18                                                      
CONECT   47   18                                                      
CONECT   48   20                                                      
CONECT   49   20                                                      
CONECT   50   20                                                      
CONECT   51   21                                                      
CONECT   52   21                                                      
CONECT   53   21                                                      
CONECT   54   24                                                      
CONECT   55   24                                                      
CONECT   56   25                                                      
CONECT   57   26                                                      
CONECT   58   27                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   30                                                      
CONECT   62   31                                                      
CONECT   63   31                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   12                                                      
MASTER        0    0    0    0    0    0    0    0   66    0   66    0
END
