COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -3.813   2.123   1.516  1.00  0.00           C  
HETATM    2  C   UNL     1      -5.048   1.294   1.273  1.00  0.00           C  
HETATM    3  C   UNL     1      -6.307   1.571   2.053  1.00  0.00           C  
HETATM    4  C   UNL     1      -5.027   0.333   0.383  1.00  0.00           C  
HETATM    5  C   UNL     1      -3.736  -0.027  -0.307  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.461  -1.521  -0.127  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.170  -1.880  -0.817  1.00  0.00           C  
HETATM    8  C   UNL     1      -2.167  -2.205  -2.288  1.00  0.00           C  
HETATM    9  C   UNL     1      -1.051  -1.911  -0.137  1.00  0.00           C  
HETATM   10  C   UNL     1       0.257  -2.142  -0.849  1.00  0.00           C  
HETATM   11  C   UNL     1       1.217  -1.030  -0.511  1.00  0.00           C  
HETATM   12  C   UNL     1       1.255   0.113  -1.290  1.00  0.00           C  
HETATM   13  O   UNL     1       0.429   0.238  -2.359  1.00  0.00           O  
HETATM   14  C   UNL     1       2.153   1.145  -0.966  1.00  0.00           C  
HETATM   15  C   UNL     1       2.203   2.361  -1.782  1.00  0.00           C  
HETATM   16  O   UNL     1       1.404   2.521  -2.681  1.00  0.00           O  
HETATM   17  C   UNL     1       3.001   1.005   0.141  1.00  0.00           C  
HETATM   18  C   UNL     1       3.967   2.107   0.494  1.00  0.00           C  
HETATM   19  C   UNL     1       2.953  -0.128   0.900  1.00  0.00           C  
HETATM   20 CL   UNL     1       4.005  -0.295   2.271  1.00  0.00          Cl  
HETATM   21  C   UNL     1       2.059  -1.150   0.585  1.00  0.00           C  
HETATM   22  O   UNL     1       2.016  -2.270   1.350  1.00  0.00           O  
HETATM   23  H   UNL     1      -4.046   2.924   2.218  1.00  0.00           H  
HETATM   24  H   UNL     1      -3.028   1.492   1.932  1.00  0.00           H  
HETATM   25  H   UNL     1      -3.473   2.553   0.574  1.00  0.00           H  
HETATM   26  H   UNL     1      -6.134   2.399   2.740  1.00  0.00           H  
HETATM   27  H   UNL     1      -7.111   1.832   1.365  1.00  0.00           H  
HETATM   28  H   UNL     1      -6.587   0.682   2.619  1.00  0.00           H  
HETATM   29  H   UNL     1      -5.934  -0.201   0.144  1.00  0.00           H  
HETATM   30  H   UNL     1      -3.816   0.202  -1.370  1.00  0.00           H  
HETATM   31  H   UNL     1      -2.919   0.549   0.128  1.00  0.00           H  
HETATM   32  H   UNL     1      -3.381  -1.750   0.936  1.00  0.00           H  
HETATM   33  H   UNL     1      -4.278  -2.096  -0.562  1.00  0.00           H  
HETATM   34  H   UNL     1      -3.192  -2.217  -2.659  1.00  0.00           H  
HETATM   35  H   UNL     1      -1.595  -1.450  -2.826  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.713  -3.184  -2.443  1.00  0.00           H  
HETATM   37  H   UNL     1      -1.065  -1.770   0.934  1.00  0.00           H  
HETATM   38  H   UNL     1       0.680  -3.096  -0.533  1.00  0.00           H  
HETATM   39  H   UNL     1       0.086  -2.159  -1.926  1.00  0.00           H  
HETATM   40  H   UNL     1       0.802  -0.097  -3.185  1.00  0.00           H  
HETATM   41  H   UNL     1       2.950   3.115  -1.583  1.00  0.00           H  
HETATM   42  H   UNL     1       3.512   2.766   1.234  1.00  0.00           H  
HETATM   43  H   UNL     1       4.879   1.673   0.906  1.00  0.00           H  
HETATM   44  H   UNL     1       4.209   2.679  -0.402  1.00  0.00           H  
HETATM   45  H   UNL     1       2.618  -2.968   1.059  1.00  0.00           H  
CONECT    1    2   23   24   25                                       
CONECT    2    4    4    3    1                                       
CONECT    3    2   26   27   28                                       
CONECT    4    5    2    2   29                                       
CONECT    5    6    4   30   31                                       
CONECT    6    7    5   32   33                                       
CONECT    7    9    9    6    8                                       
CONECT    8    7   34   35   36                                       
CONECT    9   10    7    7   37                                       
CONECT   10    9   11   38   39                                       
CONECT   11   12   10   21   21                                       
CONECT   12   13   14   14   11                                       
CONECT   13   12   40                                                 
CONECT   14   15   12   12   17                                       
CONECT   15   16   16   14   41                                       
CONECT   16   15   15                                                 
CONECT   17   14   18   19   19                                       
CONECT   18   17   42   43   44                                       
CONECT   19   17   17   21   20                                       
CONECT   20   19                                                      
CONECT   21   11   11   19   22                                       
CONECT   22   21   45                                                 
CONECT   23    1                                                      
CONECT   24    1                                                      
CONECT   25    1                                                      
CONECT   26    3                                                      
CONECT   27    3                                                      
CONECT   28    3                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    5                                                      
CONECT   32    6                                                      
CONECT   33    6                                                      
CONECT   34    8                                                      
CONECT   35    8                                                      
CONECT   36    8                                                      
CONECT   37    9                                                      
CONECT   38   10                                                      
CONECT   39   10                                                      
CONECT   40   13                                                      
CONECT   41   15                                                      
CONECT   42   18                                                      
CONECT   43   18                                                      
CONECT   44   18                                                      
CONECT   45   22                                                      
MASTER        0    0    0    0    0    0    0    0   45    0   45    0
END
