COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1       2.209   2.506   0.044  1.00  0.00           O  
HETATM    2  C   UNL     1       2.635   1.219   0.062  1.00  0.00           C  
HETATM    3  C   UNL     1       2.002   0.287   0.866  1.00  0.00           C  
HETATM    4  C   UNL     1       0.834   0.702   1.725  1.00  0.00           C  
HETATM    5  C   UNL     1      -0.446   0.529   0.948  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.291   1.525   0.850  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.496   1.405  -0.047  1.00  0.00           C  
HETATM    8  C   UNL     1      -3.700   0.943   0.775  1.00  0.00           C  
HETATM    9  C   UNL     1      -4.905   0.822  -0.122  1.00  0.00           C  
HETATM   10  C   UNL     1      -5.499  -0.336  -0.269  1.00  0.00           C  
HETATM   11  C   UNL     1      -6.784  -0.430  -1.050  1.00  0.00           C  
HETATM   12  O   UNL     1      -6.639  -1.399  -2.091  1.00  0.00           O  
HETATM   13  O   UNL     1       4.020   2.950  -1.621  1.00  0.00           O  
HETATM   14  C   UNL     1       4.396   1.796  -1.600  1.00  0.00           C  
HETATM   15  C   UNL     1       3.720   0.821  -0.740  1.00  0.00           C  
HETATM   16  C   UNL     1       2.442  -1.028   0.881  1.00  0.00           C  
HETATM   17  O   UNL     1       1.819  -1.940   1.670  1.00  0.00           O  
HETATM   18  C   UNL     1      -1.059   2.791   1.633  1.00  0.00           C  
HETATM   19  C   UNL     1      -4.898  -1.574   0.344  1.00  0.00           C  
HETATM   20  C   UNL     1      -7.920  -0.852  -0.116  1.00  0.00           C  
HETATM   21  C   UNL     1       4.152  -0.512  -0.713  1.00  0.00           C  
HETATM   22  C   UNL     1       3.520  -1.419   0.090  1.00  0.00           C  
HETATM   23 CL   UNL     1       4.059  -3.069   0.118  1.00  0.00          Cl  
HETATM   24  C   UNL     1       5.313  -0.946  -1.570  1.00  0.00           C  
HETATM   25  H   UNL     1       2.640   3.072   0.699  1.00  0.00           H  
HETATM   26  H   UNL     1       0.803   0.081   2.620  1.00  0.00           H  
HETATM   27  H   UNL     1       0.947   1.747   2.011  1.00  0.00           H  
HETATM   28  H   UNL     1      -0.666  -0.415   0.474  1.00  0.00           H  
HETATM   29  H   UNL     1      -2.713   2.374  -0.496  1.00  0.00           H  
HETATM   30  H   UNL     1      -2.293   0.677  -0.833  1.00  0.00           H  
HETATM   31  H   UNL     1      -3.483  -0.026   1.225  1.00  0.00           H  
HETATM   32  H   UNL     1      -7.015   0.541  -1.488  1.00  0.00           H  
HETATM   33  H   UNL     1      -6.432  -2.289  -1.773  1.00  0.00           H  
HETATM   34  H   UNL     1       5.228   1.488  -2.215  1.00  0.00           H  
HETATM   35  H   UNL     1       1.084  -2.397   1.239  1.00  0.00           H  
HETATM   36  H   UNL     1      -0.376   3.439   1.083  1.00  0.00           H  
HETATM   37  H   UNL     1      -2.008   3.306   1.782  1.00  0.00           H  
HETATM   38  H   UNL     1      -0.624   2.545   2.602  1.00  0.00           H  
HETATM   39  H   UNL     1      -5.210  -1.653   1.385  1.00  0.00           H  
HETATM   40  H   UNL     1      -5.237  -2.453  -0.205  1.00  0.00           H  
HETATM   41  H   UNL     1      -3.811  -1.513   0.295  1.00  0.00           H  
HETATM   42  H   UNL     1      -8.031  -0.113   0.678  1.00  0.00           H  
HETATM   43  H   UNL     1      -8.849  -0.920  -0.681  1.00  0.00           H  
HETATM   44  H   UNL     1      -7.689  -1.823   0.322  1.00  0.00           H  
HETATM   45  H   UNL     1       6.241  -0.824  -1.012  1.00  0.00           H  
HETATM   46  H   UNL     1       5.189  -1.992  -1.847  1.00  0.00           H  
HETATM   47  H   UNL     1       5.348  -0.333  -2.471  1.00  0.00           H  
HETATM   48  H   UNL     1      -5.279   1.691  -0.643  1.00  0.00           H  
HETATM   49  H   UNL     1      -3.904   1.670   1.561  1.00  0.00           H  
CONECT    1    2   25                                                 
CONECT    2    1    3    3   15                                       
CONECT    3    2    2    4   16                                       
CONECT    4    3    5   26   27                                       
CONECT    5    4    6    6   28                                       
CONECT    6    5    5    7   18                                       
CONECT    7    6    8   29   30                                       
CONECT    8    7    9   31   49                                       
CONECT    9    8   10   10   48                                       
CONECT   10    9    9   11   19                                       
CONECT   11   10   12   20   32                                       
CONECT   12   11   33                                                 
CONECT   13   14   14                                                 
CONECT   14   13   13   15   34                                       
CONECT   15    2   14   21   21                                       
CONECT   16    3   17   22   22                                       
CONECT   17   16   35                                                 
CONECT   18    6   36   37   38                                       
CONECT   19   10   39   40   41                                       
CONECT   20   11   42   43   44                                       
CONECT   21   15   15   22   24                                       
CONECT   22   16   16   21   23                                       
CONECT   23   22                                                      
CONECT   24   21   45   46   47                                       
CONECT   25    1                                                      
CONECT   26    4                                                      
CONECT   27    4                                                      
CONECT   28    5                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    8                                                      
CONECT   32   11                                                      
CONECT   33   12                                                      
CONECT   34   14                                                      
CONECT   35   17                                                      
CONECT   36   18                                                      
CONECT   37   18                                                      
CONECT   38   18                                                      
CONECT   39   19                                                      
CONECT   40   19                                                      
CONECT   41   19                                                      
CONECT   42   20                                                      
CONECT   43   20                                                      
CONECT   44   20                                                      
CONECT   45   24                                                      
CONECT   46   24                                                      
CONECT   47   24                                                      
CONECT   48    9                                                      
CONECT   49    8                                                      
MASTER        0    0    0    0    0    0    0    0   49    0   49    0
END
