COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  N   UNL     1      -5.684  -0.961   0.137  1.00  0.00           N  
HETATM    2  N   UNL     1       9.967  -1.778   1.071  1.00  0.00           N  
HETATM    3  C   UNL     1       1.654   2.919  -0.095  1.00  0.00           C  
HETATM    4  C   UNL     1      -0.734   3.442   0.129  1.00  0.00           C  
HETATM    5  C   UNL     1      -2.021   2.999   0.189  1.00  0.00           C  
HETATM    6  C   UNL     1      -2.319   1.639   0.097  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.332   0.714  -0.055  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.937   0.245   1.360  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.122   0.446  -1.120  1.00  0.00           C  
HETATM   10  C   UNL     1      -7.186  -2.399   1.483  1.00  0.00           C  
HETATM   11  C   UNL     1      -7.174  -2.620  -0.943  1.00  0.00           C  
HETATM   12  C   UNL     1       5.832  -0.651  -0.729  1.00  0.00           C  
HETATM   13  C   UNL     1       6.628  -0.428  -2.016  1.00  0.00           C  
HETATM   14  C   UNL     1       7.248  -0.075  -0.663  1.00  0.00           C  
HETATM   15  C   UNL     1       9.115  -0.739   0.942  1.00  0.00           C  
HETATM   16  C   UNL     1      10.980  -1.936   2.117  1.00  0.00           C  
HETATM   17  O   UNL     1       4.904   1.449  -0.182  1.00  0.00           O  
HETATM   18  C   UNL     1       4.685   0.286  -0.448  1.00  0.00           C  
HETATM   19  C   UNL     1       8.340  -0.974  -0.142  1.00  0.00           C  
HETATM   20  C   UNL     1       8.732  -2.198  -0.694  1.00  0.00           C  
HETATM   21  N   UNL     1       9.707  -2.681   0.032  1.00  0.00           N  
HETATM   22  N   UNL     1       3.417  -0.168  -0.493  1.00  0.00           N  
HETATM   23  C   UNL     1       2.352   0.721  -0.338  1.00  0.00           C  
HETATM   24  N   UNL     1       2.602   2.024  -0.242  1.00  0.00           N  
HETATM   25  C   UNL     1       0.310   2.517  -0.027  1.00  0.00           C  
HETATM   26 CL   UNL     1      -3.311   4.144   0.383  1.00  0.00          Cl  
HETATM   27  C   UNL     1       0.005   1.134  -0.120  1.00  0.00           C  
HETATM   28  C   UNL     1       1.066   0.226  -0.277  1.00  0.00           C  
HETATM   29  C   UNL     1      -3.755   1.188   0.168  1.00  0.00           C  
HETATM   30  C   UNL     1      -5.562  -0.062  -1.018  1.00  0.00           C  
HETATM   31  C   UNL     1      -5.383  -0.258   1.391  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.017  -1.577   0.186  1.00  0.00           C  
HETATM   33  C   UNL     1      -8.107  -0.508   0.083  1.00  0.00           C  
HETATM   34  O   UNL     1      -5.978  -2.697  -1.722  1.00  0.00           O  
HETATM   35  C   UNL     1      -7.418  -3.949  -0.194  1.00  0.00           C  
HETATM   36  O   UNL     1      -7.953  -3.557   1.089  1.00  0.00           O  
HETATM   37  H   UNL     1       1.908   3.966  -0.022  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.519   4.498   0.201  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.576  -0.336  -0.124  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.259  -0.603   1.260  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.718   0.779   2.284  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.036   1.125  -1.969  1.00  0.00           H  
HETATM   43  H   UNL     1      -3.447  -0.398  -1.260  1.00  0.00           H  
HETATM   44  H   UNL     1      -6.213  -2.702   1.870  1.00  0.00           H  
HETATM   45  H   UNL     1      -7.727  -1.820   2.232  1.00  0.00           H  
HETATM   46  H   UNL     1      -8.026  -2.373  -1.576  1.00  0.00           H  
HETATM   47  H   UNL     1       5.690  -1.680  -0.397  1.00  0.00           H  
HETATM   48  H   UNL     1       7.011  -1.309  -2.531  1.00  0.00           H  
HETATM   49  H   UNL     1       6.323   0.397  -2.660  1.00  0.00           H  
HETATM   50  H   UNL     1       7.350   0.981  -0.416  1.00  0.00           H  
HETATM   51  H   UNL     1       9.061   0.125   1.588  1.00  0.00           H  
HETATM   52  H   UNL     1      11.918  -1.491   1.785  1.00  0.00           H  
HETATM   53  H   UNL     1      10.644  -1.438   3.027  1.00  0.00           H  
HETATM   54  H   UNL     1      11.132  -2.997   2.319  1.00  0.00           H  
HETATM   55  H   UNL     1       8.303  -2.664  -1.569  1.00  0.00           H  
HETATM   56  H   UNL     1       3.245  -1.112  -0.634  1.00  0.00           H  
HETATM   57  H   UNL     1       0.879  -0.835  -0.352  1.00  0.00           H  
HETATM   58  H   UNL     1      -4.405   2.055   0.287  1.00  0.00           H  
HETATM   59  H   UNL     1      -5.822  -0.603  -1.928  1.00  0.00           H  
HETATM   60  H   UNL     1      -6.238   0.784  -0.893  1.00  0.00           H  
HETATM   61  H   UNL     1      -6.059   0.589   1.504  1.00  0.00           H  
HETATM   62  H   UNL     1      -5.512  -0.941   2.230  1.00  0.00           H  
HETATM   63  H   UNL     1      -8.032   0.171   0.933  1.00  0.00           H  
HETATM   64  H   UNL     1      -7.980   0.053  -0.842  1.00  0.00           H  
HETATM   65  H   UNL     1      -9.087  -0.986   0.086  1.00  0.00           H  
HETATM   66  H   UNL     1      -6.011  -3.358  -2.428  1.00  0.00           H  
HETATM   67  H   UNL     1      -8.140  -4.562  -0.735  1.00  0.00           H  
HETATM   68  H   UNL     1      -6.481  -4.491  -0.067  1.00  0.00           H  
CONECT    1   32   31   30                                            
CONECT    2   15   21   16                                            
CONECT    3   25   24   24   37                                       
CONECT    4    5   25   25   38                                       
CONECT    5   26    6    6    4                                       
CONECT    6   29    5    5    7                                       
CONECT    7    6   27   27   39                                       
CONECT    8   31   29   40   41                                       
CONECT    9   30   29   42   43                                       
CONECT   10   36   32   44   45                                       
CONECT   11   35   32   34   46                                       
CONECT   12   18   13   14   47                                       
CONECT   13   12   14   48   49                                       
CONECT   14   13   12   19   50                                       
CONECT   15   19   19    2   51                                       
CONECT   16    2   52   53   54                                       
CONECT   17   18   18                                                 
CONECT   18   17   17   22   12                                       
CONECT   19   14   15   15   20                                       
CONECT   20   19   21   21   55                                       
CONECT   21   20   20    2                                            
CONECT   22   23   18   56                                            
CONECT   23   28   28   24   22                                       
CONECT   24    3    3   23                                            
CONECT   25    4    4   27    3                                       
CONECT   26    5                                                      
CONECT   27    7    7   25   28                                       
CONECT   28   27   23   23   57                                       
CONECT   29    8    9    6   58                                       
CONECT   30    1    9   59   60                                       
CONECT   31    1    8   61   62                                       
CONECT   32   10   33   11    1                                       
CONECT   33   32   63   64   65                                       
CONECT   34   11   66                                                 
CONECT   35   36   11   67   68                                       
CONECT   36   35   10                                                 
CONECT   37    3                                                      
CONECT   38    4                                                      
CONECT   39    7                                                      
CONECT   40    8                                                      
CONECT   41    8                                                      
CONECT   42    9                                                      
CONECT   43    9                                                      
CONECT   44   10                                                      
CONECT   45   10                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   13                                                      
CONECT   49   13                                                      
CONECT   50   14                                                      
CONECT   51   15                                                      
CONECT   52   16                                                      
CONECT   53   16                                                      
CONECT   54   16                                                      
CONECT   55   20                                                      
CONECT   56   22                                                      
CONECT   57   28                                                      
CONECT   58   29                                                      
CONECT   59   30                                                      
CONECT   60   30                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   33                                                      
CONECT   64   33                                                      
CONECT   65   33                                                      
CONECT   66   34                                                      
CONECT   67   35                                                      
CONECT   68   35                                                      
MASTER        0    0    0    0    0    0    0    0   68    0   68    0
END
