COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.113  -1.509   1.458  1.00  0.00           C  
HETATM    2  C   UNL     1      -4.000  -2.755   1.381  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.572  -3.603   0.180  1.00  0.00           C  
HETATM    4  C   UNL     1      -2.817  -1.665  -1.015  1.00  0.00           C  
HETATM    5  C   UNL     1       1.278   0.981  -0.465  1.00  0.00           C  
HETATM    6  C   UNL     1       2.127  -0.036  -0.840  1.00  0.00           C  
HETATM    7  C   UNL     1       2.678  -0.876   0.122  1.00  0.00           C  
HETATM    8  C   UNL     1       1.535   0.329   1.852  1.00  0.00           C  
HETATM    9  C   UNL     1       0.974   1.173   0.886  1.00  0.00           C  
HETATM   10  C   UNL     1       0.075   2.269   1.294  1.00  0.00           C  
HETATM   11  C   UNL     1      -0.301   4.344  -0.115  1.00  0.00           C  
HETATM   12  C   UNL     1      -0.613   3.072   0.274  1.00  0.00           C  
HETATM   13  C   UNL     1      -2.566   1.516  -0.625  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.072   3.761  -1.362  1.00  0.00           C  
HETATM   15  C   UNL     1      -4.492  -4.819   0.060  1.00  0.00           C  
HETATM   16  O   UNL     1      -4.023  -5.670  -0.988  1.00  0.00           O  
HETATM   17  O   UNL     1      -3.661  -2.819  -1.011  1.00  0.00           O  
HETATM   18  C   UNL     1      -3.213  -0.739   0.138  1.00  0.00           C  
HETATM   19  N   UNL     1      -2.310   0.414   0.171  1.00  0.00           N  
HETATM   20  C   UNL     1      -1.775   2.668  -0.533  1.00  0.00           C  
HETATM   21  N   UNL     1      -3.569   1.508  -1.499  1.00  0.00           N  
HETATM   22  C   UNL     1      -3.815   2.558  -2.261  1.00  0.00           C  
HETATM   23  N   UNL     1      -3.098   3.659  -2.205  1.00  0.00           N  
HETATM   24  N   UNL     1      -1.168   4.752  -1.077  1.00  0.00           N  
HETATM   25  O   UNL     1      -0.098   2.508   2.475  1.00  0.00           O  
HETATM   26 CL   UNL     1       1.155   0.556   3.530  1.00  0.00          Cl  
HETATM   27  C   UNL     1       2.375  -0.693   1.466  1.00  0.00           C  
HETATM   28  O   UNL     1       3.515  -1.876  -0.252  1.00  0.00           O  
HETATM   29  C   UNL     1       4.759  -1.540  -0.683  1.00  0.00           C  
HETATM   30  C   UNL     1       5.178  -0.218  -0.634  1.00  0.00           C  
HETATM   31  C   UNL     1       6.443   0.121  -1.073  1.00  0.00           C  
HETATM   32  C   UNL     1       7.292  -0.856  -1.560  1.00  0.00           C  
HETATM   33  C   UNL     1       6.877  -2.174  -1.611  1.00  0.00           C  
HETATM   34  C   UNL     1       5.615  -2.519  -1.168  1.00  0.00           C  
HETATM   35  H   UNL     1      -3.448  -0.873   2.278  1.00  0.00           H  
HETATM   36  H   UNL     1      -2.078  -1.808   1.629  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.891  -3.338   2.295  1.00  0.00           H  
HETATM   38  H   UNL     1      -5.041  -2.454   1.263  1.00  0.00           H  
HETATM   39  H   UNL     1      -2.544  -3.937   0.319  1.00  0.00           H  
HETATM   40  H   UNL     1      -1.780  -1.977  -0.891  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.927  -1.135  -1.961  1.00  0.00           H  
HETATM   42  H   UNL     1       0.851   1.632  -1.213  1.00  0.00           H  
HETATM   43  H   UNL     1       2.366  -0.182  -1.883  1.00  0.00           H  
HETATM   44  H   UNL     1       0.508   4.936   0.286  1.00  0.00           H  
HETATM   45  H   UNL     1      -4.493  -5.369   1.001  1.00  0.00           H  
HETATM   46  H   UNL     1      -5.505  -4.488  -0.168  1.00  0.00           H  
HETATM   47  H   UNL     1      -4.560  -6.464  -1.121  1.00  0.00           H  
HETATM   48  H   UNL     1      -4.238  -0.397  -0.005  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.533   0.405   0.752  1.00  0.00           H  
HETATM   50  H   UNL     1      -4.639   2.511  -2.957  1.00  0.00           H  
HETATM   51  H   UNL     1      -1.145   5.621  -1.507  1.00  0.00           H  
HETATM   52  H   UNL     1       2.808  -1.345   2.210  1.00  0.00           H  
HETATM   53  H   UNL     1       4.515   0.545  -0.254  1.00  0.00           H  
HETATM   54  H   UNL     1       6.769   1.150  -1.035  1.00  0.00           H  
HETATM   55  H   UNL     1       8.281  -0.589  -1.903  1.00  0.00           H  
HETATM   56  H   UNL     1       7.542  -2.934  -1.992  1.00  0.00           H  
HETATM   57  H   UNL     1       5.291  -3.549  -1.207  1.00  0.00           H  
CONECT    1    2   18   35   36                                       
CONECT    2    3    1   37   38                                       
CONECT    3   15   17    2   39                                       
CONECT    4   17   18   40   41                                       
CONECT    5    9    6    6   42                                       
CONECT    6    5    5    7   43                                       
CONECT    7   27   27    6   28                                       
CONECT    8   26    9    9   27                                       
CONECT    9   10    8    8    5                                       
CONECT   10   12   25   25    9                                       
CONECT   11   24   12   12   44                                       
CONECT   12   20   11   11   10                                       
CONECT   13   21   19   20   20                                       
CONECT   14   23   23   20   24                                       
CONECT   15   16    3   45   46                                       
CONECT   16   15   47                                                 
CONECT   17    4    3                                                 
CONECT   18    4    1   19   48                                       
CONECT   19   18   13   49                                            
CONECT   20   13   13   14   12                                       
CONECT   21   22   22   13                                            
CONECT   22   21   21   23   50                                       
CONECT   23   22   14   14                                            
CONECT   24   14   11   51                                            
CONECT   25   10   10                                                 
CONECT   26    8                                                      
CONECT   27    8    7    7   52                                       
CONECT   28    7   29                                                 
CONECT   29   34   28   30   30                                       
CONECT   30   29   29   31   53                                       
CONECT   31   32   32   30   54                                       
CONECT   32   33   31   31   55                                       
CONECT   33   34   34   32   56                                       
CONECT   34   33   33   29   57                                       
CONECT   35    1                                                      
CONECT   36    1                                                      
CONECT   37    2                                                      
CONECT   38    2                                                      
CONECT   39    3                                                      
CONECT   40    4                                                      
CONECT   41    4                                                      
CONECT   42    5                                                      
CONECT   43    6                                                      
CONECT   44   11                                                      
CONECT   45   15                                                      
CONECT   46   15                                                      
CONECT   47   16                                                      
CONECT   48   18                                                      
CONECT   49   19                                                      
CONECT   50   22                                                      
CONECT   51   24                                                      
CONECT   52   27                                                      
CONECT   53   30                                                      
CONECT   54   31                                                      
CONECT   55   32                                                      
CONECT   56   33                                                      
CONECT   57   34                                                      
MASTER        0    0    0    0    0    0    0    0   57    0   57    0
END
