COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       5.101   1.351  -0.401  1.00  0.00           C  
HETATM    2  C   UNL     1       4.856   0.112   0.463  1.00  0.00           C  
HETATM    3  C   UNL     1       5.148  -1.147  -0.356  1.00  0.00           C  
HETATM    4  C   UNL     1       5.777   0.151   1.684  1.00  0.00           C  
HETATM    5  N   UNL     1       3.460   0.094   0.906  1.00  0.00           N  
HETATM    6  C   UNL     1       2.465   0.059  -0.003  1.00  0.00           C  
HETATM    7  O   UNL     1       2.726   0.043  -1.188  1.00  0.00           O  
HETATM    8  C   UNL     1       1.028   0.040   0.452  1.00  0.00           C  
HETATM    9  O   UNL     1       0.168   0.003  -0.688  1.00  0.00           O  
HETATM   10  C   UNL     1      -1.171  -0.018  -0.450  1.00  0.00           C  
HETATM   11  C   UNL     1      -1.832  -1.228  -0.302  1.00  0.00           C  
HETATM   12 CL   UNL     1      -0.950  -2.718  -0.419  1.00  0.00          Cl  
HETATM   13  C   UNL     1      -3.194  -1.247  -0.060  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.899  -0.061   0.033  1.00  0.00           C  
HETATM   15  C   UNL     1      -5.383  -0.087   0.296  1.00  0.00           C  
HETATM   16  N   UNL     1      -5.624  -0.060   1.745  1.00  0.00           N  
HETATM   17  C   UNL     1      -3.246   1.149  -0.113  1.00  0.00           C  
HETATM   18  C   UNL     1      -1.880   1.175  -0.350  1.00  0.00           C  
HETATM   19  O   UNL     1      -1.236   2.365  -0.489  1.00  0.00           O  
HETATM   20  C   UNL     1      -2.028   3.549  -0.374  1.00  0.00           C  
HETATM   21  H   UNL     1       6.140   1.365  -0.730  1.00  0.00           H  
HETATM   22  H   UNL     1       4.444   1.323  -1.270  1.00  0.00           H  
HETATM   23  H   UNL     1       4.893   2.248   0.183  1.00  0.00           H  
HETATM   24  H   UNL     1       6.187  -1.133  -0.686  1.00  0.00           H  
HETATM   25  H   UNL     1       4.973  -2.029   0.259  1.00  0.00           H  
HETATM   26  H   UNL     1       4.491  -1.175  -1.226  1.00  0.00           H  
HETATM   27  H   UNL     1       5.569   1.048   2.267  1.00  0.00           H  
HETATM   28  H   UNL     1       5.603  -0.732   2.299  1.00  0.00           H  
HETATM   29  H   UNL     1       6.816   0.165   1.354  1.00  0.00           H  
HETATM   30  H   UNL     1       3.251   0.106   1.853  1.00  0.00           H  
HETATM   31  H   UNL     1       0.854  -0.843   1.068  1.00  0.00           H  
HETATM   32  H   UNL     1       0.821   0.937   1.036  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.708  -2.189   0.055  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.849   0.783  -0.166  1.00  0.00           H  
HETATM   35  H   UNL     1      -5.810  -0.996  -0.127  1.00  0.00           H  
HETATM   36  H   UNL     1      -6.612  -0.076   1.947  1.00  0.00           H  
HETATM   37  H   UNL     1      -5.147  -0.821   2.205  1.00  0.00           H  
HETATM   38  H   UNL     1      -3.799   2.073  -0.040  1.00  0.00           H  
HETATM   39  H   UNL     1      -1.392   4.425  -0.505  1.00  0.00           H  
HETATM   40  H   UNL     1      -2.802   3.544  -1.141  1.00  0.00           H  
HETATM   41  H   UNL     1      -2.492   3.581   0.612  1.00  0.00           H  
CONECT    1    2   21   22   23                                       
CONECT    2    5    1    4    3                                       
CONECT    3    2   24   25   26                                       
CONECT    4    2   27   28   29                                       
CONECT    5    6    2   30                                            
CONECT    6    8    7    7    5                                       
CONECT    7    6    6                                                 
CONECT    8    9    6   31   32                                       
CONECT    9    8   10                                                 
CONECT   10   11    9   18   18                                       
CONECT   11   12   13   13   10                                       
CONECT   12   11                                                      
CONECT   13   11   11   14   33                                       
CONECT   14   13   15   17   17                                       
CONECT   15   16   14   34   35                                       
CONECT   16   15   36   37                                            
CONECT   17   14   14   18   38                                       
CONECT   18   10   10   17   19                                       
CONECT   19   18   20                                                 
CONECT   20   19   39   40   41                                       
CONECT   21    1                                                      
CONECT   22    1                                                      
CONECT   23    1                                                      
CONECT   24    3                                                      
CONECT   25    3                                                      
CONECT   26    3                                                      
CONECT   27    4                                                      
CONECT   28    4                                                      
CONECT   29    4                                                      
CONECT   30    5                                                      
CONECT   31    8                                                      
CONECT   32    8                                                      
CONECT   33   13                                                      
CONECT   34   15                                                      
CONECT   35   15                                                      
CONECT   36   16                                                      
CONECT   37   16                                                      
CONECT   38   17                                                      
CONECT   39   20                                                      
CONECT   40   20                                                      
CONECT   41   20                                                      
MASTER        0    0    0    0    0    0    0    0   41    0   41    0
END
