COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       0.797   0.741   1.060  1.00  0.00           C  
HETATM    2  C   UNL     1       0.149   0.305   2.229  1.00  0.00           C  
HETATM    3  C   UNL     1       0.884  -0.292   3.253  1.00  0.00           C  
HETATM    4  C   UNL     1       2.251  -0.441   3.114  1.00  0.00           C  
HETATM    5  C   UNL     1       2.889  -0.009   1.956  1.00  0.00           C  
HETATM    6  C   UNL     1       2.171   0.577   0.937  1.00  0.00           C  
HETATM    7  C   UNL     1       4.335  -1.036   3.677  1.00  0.00           C  
HETATM    8  C   UNL     1      -1.272   0.617   2.048  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.401   1.194   0.845  1.00  0.00           C  
HETATM   10  C   UNL     1       0.051   1.807  -0.985  1.00  0.00           C  
HETATM   11  C   UNL     1       0.094   0.931  -2.173  1.00  0.00           C  
HETATM   12  C   UNL     1       0.433   1.458  -3.421  1.00  0.00           C  
HETATM   13  C   UNL     1       0.473   0.634  -4.526  1.00  0.00           C  
HETATM   14  C   UNL     1       0.177  -0.712  -4.400  1.00  0.00           C  
HETATM   15  C   UNL     1      -0.159  -1.241  -3.165  1.00  0.00           C  
HETATM   16  C   UNL     1      -0.196  -0.429  -2.051  1.00  0.00           C  
HETATM   17  C   UNL     1      -2.699   1.677   0.250  1.00  0.00           C  
HETATM   18  C   UNL     1      -2.381   0.341   3.030  1.00  0.00           C  
HETATM   19  C   UNL     1      -2.956  -1.026   2.767  1.00  0.00           C  
HETATM   20  N   UNL     1      -0.173   1.279   0.233  1.00  0.00           N  
HETATM   21  O   UNL     1       2.974  -1.018   4.111  1.00  0.00           O  
HETATM   22  O   UNL     1       0.217   3.005  -1.107  1.00  0.00           O  
HETATM   23  O   UNL     1      -2.512  -1.707   1.874  1.00  0.00           O  
HETATM   24  O   UNL     1      -3.963  -1.488   3.526  1.00  0.00           O  
HETATM   25 CL   UNL     1       0.229  -1.743  -5.796  1.00  0.00          Cl  
HETATM   26  H   UNL     1       0.389  -0.633   4.150  1.00  0.00           H  
HETATM   27  H   UNL     1       3.957  -0.134   1.855  1.00  0.00           H  
HETATM   28  H   UNL     1       2.676   0.910   0.042  1.00  0.00           H  
HETATM   29  H   UNL     1       4.957  -1.492   4.447  1.00  0.00           H  
HETATM   30  H   UNL     1       4.415  -1.614   2.756  1.00  0.00           H  
HETATM   31  H   UNL     1       4.672  -0.015   3.495  1.00  0.00           H  
HETATM   32  H   UNL     1       0.664   2.508  -3.520  1.00  0.00           H  
HETATM   33  H   UNL     1       0.734   1.041  -5.492  1.00  0.00           H  
HETATM   34  H   UNL     1      -0.389  -2.292  -3.073  1.00  0.00           H  
HETATM   35  H   UNL     1      -0.459  -0.842  -1.089  1.00  0.00           H  
HETATM   36  H   UNL     1      -3.160   0.870  -0.319  1.00  0.00           H  
HETATM   37  H   UNL     1      -3.371   1.987   1.050  1.00  0.00           H  
HETATM   38  H   UNL     1      -2.504   2.523  -0.408  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.985   0.380   4.045  1.00  0.00           H  
HETATM   40  H   UNL     1      -3.163   1.092   2.916  1.00  0.00           H  
HETATM   41  H   UNL     1      -4.332  -2.365   3.357  1.00  0.00           H  
CONECT    1    2    2    6   20                                       
CONECT    2    1    1    3    8                                       
CONECT    3    2    4    4   26                                       
CONECT    4    3    3    5   21                                       
CONECT    5    4    6    6   27                                       
CONECT    6    1    5    5   28                                       
CONECT    7   21   29   30   31                                       
CONECT    8    2    9    9   18                                       
CONECT    9    8    8   17   20                                       
CONECT   10   11   20   22   22                                       
CONECT   11   10   12   12   16                                       
CONECT   12   11   11   13   32                                       
CONECT   13   12   14   14   33                                       
CONECT   14   13   13   15   25                                       
CONECT   15   14   16   16   34                                       
CONECT   16   11   15   15   35                                       
CONECT   17    9   36   37   38                                       
CONECT   18    8   19   39   40                                       
CONECT   19   18   23   23   24                                       
CONECT   20    1    9   10                                            
CONECT   21    4    7                                                 
CONECT   22   10   10                                                 
CONECT   23   19   19                                                 
CONECT   24   19   41                                                 
CONECT   25   14                                                      
CONECT   26    3                                                      
CONECT   27    5                                                      
CONECT   28    6                                                      
CONECT   29    7                                                      
CONECT   30    7                                                      
CONECT   31    7                                                      
CONECT   32   12                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   16                                                      
CONECT   36   17                                                      
CONECT   37   17                                                      
CONECT   38   17                                                      
CONECT   39   18                                                      
CONECT   40   18                                                      
CONECT   41   24                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
