COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -5.297   0.447  -0.166  1.00  0.00           C  
HETATM    2  C   UNL     1      -7.152   0.489   1.508  1.00  0.00           C  
HETATM    3  C   UNL     1      -3.620  -2.396  -0.119  1.00  0.00           C  
HETATM    4  C   UNL     1       2.646   2.932  -0.250  1.00  0.00           C  
HETATM    5  C   UNL     1       4.014   2.863  -0.063  1.00  0.00           C  
HETATM    6 CL   UNL     1       1.860   4.460  -0.499  1.00  0.00          Cl  
HETATM    7  N   UNL     1       4.582   1.680   0.123  1.00  0.00           N  
HETATM    8  C   UNL     1       3.860   0.572   0.133  1.00  0.00           C  
HETATM    9  N   UNL     1       4.498  -0.653   0.333  1.00  0.00           N  
HETATM   10  N   UNL     1       3.881  -1.910   0.365  1.00  0.00           N  
HETATM   11  C   UNL     1       4.802  -2.814   0.574  1.00  0.00           C  
HETATM   12  C   UNL     1       4.573  -4.299   0.679  1.00  0.00           C  
HETATM   13  C   UNL     1       6.039  -2.167   0.683  1.00  0.00           C  
HETATM   14  C   UNL     1       5.831  -0.840   0.527  1.00  0.00           C  
HETATM   15  C   UNL     1       6.884   0.237   0.564  1.00  0.00           C  
HETATM   16  C   UNL     1       1.912   1.743  -0.240  1.00  0.00           C  
HETATM   17  N   UNL     1       2.549   0.594  -0.042  1.00  0.00           N  
HETATM   18  N   UNL     1       0.538   1.763  -0.428  1.00  0.00           N  
HETATM   19  C   UNL     1      -0.171   0.561  -0.533  1.00  0.00           C  
HETATM   20  C   UNL     1       0.426  -0.548  -1.122  1.00  0.00           C  
HETATM   21  C   UNL     1      -0.268  -1.737  -1.228  1.00  0.00           C  
HETATM   22  C   UNL     1      -1.565  -1.826  -0.746  1.00  0.00           C  
HETATM   23  C   UNL     1      -2.168  -0.714  -0.154  1.00  0.00           C  
HETATM   24  C   UNL     1      -1.469   0.478  -0.049  1.00  0.00           C  
HETATM   25  N   UNL     1      -2.500  -2.860  -0.706  1.00  0.00           N  
HETATM   26  C   UNL     1      -2.299  -4.219  -1.214  1.00  0.00           C  
HETATM   27  O   UNL     1      -4.631  -3.045   0.073  1.00  0.00           O  
HETATM   28  N   UNL     1      -3.449  -1.106   0.227  1.00  0.00           N  
HETATM   29  C   UNL     1      -4.443  -0.258   0.890  1.00  0.00           C  
HETATM   30  C   UNL     1      -6.335   1.332   0.526  1.00  0.00           C  
HETATM   31  O   UNL     1      -5.671   2.380   1.235  1.00  0.00           O  
HETATM   32  C   UNL     1      -7.269   1.939  -0.523  1.00  0.00           C  
HETATM   33  H   UNL     1      -4.658   1.062  -0.799  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.806  -0.298  -0.778  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.487   0.057   2.256  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.891   1.120   2.001  1.00  0.00           H  
HETATM   37  H   UNL     1      -7.659  -0.310   0.967  1.00  0.00           H  
HETATM   38  H   UNL     1       4.613   3.761  -0.070  1.00  0.00           H  
HETATM   39  H   UNL     1       4.655  -4.751  -0.309  1.00  0.00           H  
HETATM   40  H   UNL     1       5.319  -4.737   1.342  1.00  0.00           H  
HETATM   41  H   UNL     1       3.577  -4.485   1.082  1.00  0.00           H  
HETATM   42  H   UNL     1       6.992  -2.644   0.858  1.00  0.00           H  
HETATM   43  H   UNL     1       7.004   0.593   1.587  1.00  0.00           H  
HETATM   44  H   UNL     1       7.831  -0.168   0.207  1.00  0.00           H  
HETATM   45  H   UNL     1       6.580   1.066  -0.076  1.00  0.00           H  
HETATM   46  H   UNL     1       0.068   2.610  -0.486  1.00  0.00           H  
HETATM   47  H   UNL     1       1.436  -0.479  -1.497  1.00  0.00           H  
HETATM   48  H   UNL     1       0.199  -2.596  -1.686  1.00  0.00           H  
HETATM   49  H   UNL     1      -1.932   1.339   0.409  1.00  0.00           H  
HETATM   50  H   UNL     1      -1.889  -4.846  -0.422  1.00  0.00           H  
HETATM   51  H   UNL     1      -3.254  -4.629  -1.544  1.00  0.00           H  
HETATM   52  H   UNL     1      -1.605  -4.194  -2.054  1.00  0.00           H  
HETATM   53  H   UNL     1      -3.935   0.487   1.502  1.00  0.00           H  
HETATM   54  H   UNL     1      -5.082  -0.874   1.523  1.00  0.00           H  
HETATM   55  H   UNL     1      -5.133   2.955   0.674  1.00  0.00           H  
HETATM   56  H   UNL     1      -7.776   1.140  -1.064  1.00  0.00           H  
HETATM   57  H   UNL     1      -8.008   2.570  -0.030  1.00  0.00           H  
HETATM   58  H   UNL     1      -6.687   2.540  -1.223  1.00  0.00           H  
CONECT    1   30   29   33   34                                       
CONECT    2   30   35   36   37                                       
CONECT    3   28   25   27   27                                       
CONECT    4    5    6   16   16                                       
CONECT    5    7    7    4   38                                       
CONECT    6    4                                                      
CONECT    7    5    5    8                                            
CONECT    8    7    9   17   17                                       
CONECT    9   10    8   14                                            
CONECT   10   11   11    9                                            
CONECT   11   12   10   10   13                                       
CONECT   12   11   39   40   41                                       
CONECT   13   11   14   14   42                                       
CONECT   14   13   13    9   15                                       
CONECT   15   14   43   44   45                                       
CONECT   16    4    4   17   18                                       
CONECT   17    8    8   16                                            
CONECT   18   16   19   46                                            
CONECT   19   18   20   20   24                                       
CONECT   20   19   19   21   47                                       
CONECT   21   20   22   22   48                                       
CONECT   22   21   21   23   25                                       
CONECT   23   24   24   22   28                                       
CONECT   24   19   23   23   49                                       
CONECT   25   22    3   26                                            
CONECT   26   25   50   51   52                                       
CONECT   27    3    3                                                 
CONECT   28   23   29    3                                            
CONECT   29    1   28   53   54                                       
CONECT   30   32    2    1   31                                       
CONECT   31   30   55                                                 
CONECT   32   30   56   57   58                                       
CONECT   33    1                                                      
CONECT   34    1                                                      
CONECT   35    2                                                      
CONECT   36    2                                                      
CONECT   37    2                                                      
CONECT   38    5                                                      
CONECT   39   12                                                      
CONECT   40   12                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   18                                                      
CONECT   47   20                                                      
CONECT   48   21                                                      
CONECT   49   24                                                      
CONECT   50   26                                                      
CONECT   51   26                                                      
CONECT   52   26                                                      
CONECT   53   29                                                      
CONECT   54   29                                                      
CONECT   55   31                                                      
CONECT   56   32                                                      
CONECT   57   32                                                      
CONECT   58   32                                                      
MASTER        0    0    0    0    0    0    0    0   58    0   58    0
END
