COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      -0.124   2.996  -0.944  1.00  0.00           C  
HETATM    2  C   UNL     1       1.760  -2.980   1.724  1.00  0.00           C  
HETATM    3  C   UNL     1       1.755  -0.883   0.591  1.00  0.00           C  
HETATM    4  C   UNL     1       0.934  -0.126  -0.454  1.00  0.00           C  
HETATM    5  C   UNL     1      -5.030  -0.057   0.807  1.00  0.00           C  
HETATM    6  C   UNL     1      -3.806  -1.341  -0.850  1.00  0.00           C  
HETATM    7  C   UNL     1      -1.307   0.602   0.919  1.00  0.00           C  
HETATM    8  C   UNL     1      -0.990   1.576   2.041  1.00  0.00           C  
HETATM    9  C   UNL     1      -0.498   0.005   0.050  1.00  0.00           C  
HETATM   10  C   UNL     1      -2.637  -0.742  -0.377  1.00  0.00           C  
HETATM   11  C   UNL     1       4.449   1.254  -0.209  1.00  0.00           C  
HETATM   12  C   UNL     1      -4.989  -0.973  -0.232  1.00  0.00           C  
HETATM   13  C   UNL     1      -3.894   0.547   1.290  1.00  0.00           C  
HETATM   14  C   UNL     1      -2.689   0.188   0.680  1.00  0.00           C  
HETATM   15  C   UNL     1       1.195  -4.345   2.021  1.00  0.00           C  
HETATM   16  C   UNL     1       0.924  -0.924  -1.732  1.00  0.00           C  
HETATM   17  C   UNL     1       3.485   2.060   0.623  1.00  0.00           C  
HETATM   18  C   UNL     1       0.221  -1.332  -3.972  1.00  0.00           C  
HETATM   19  C   UNL     1       1.599   1.213  -0.720  1.00  0.00           C  
HETATM   20  C   UNL     1       0.739   2.007  -1.730  1.00  0.00           C  
HETATM   21  C   UNL     1       2.182   2.017   0.360  1.00  0.00           C  
HETATM   22  C   UNL     1       1.174   2.770   1.120  1.00  0.00           C  
HETATM   23  C   UNL     1      -0.979   3.001   1.476  1.00  0.00           C  
HETATM   24  N   UNL     1       0.059   3.013   0.463  1.00  0.00           N1+
HETATM   25  N   UNL     1      -1.339  -0.849  -0.715  1.00  0.00           N  
HETATM   26  O   UNL     1       1.156  -2.185   0.827  1.00  0.00           O  
HETATM   27  O   UNL     1       2.756  -2.602   2.293  1.00  0.00           O  
HETATM   28  O   UNL     1       1.583  -1.933  -1.820  1.00  0.00           O  
HETATM   29  O   UNL     1       0.182  -0.514  -2.773  1.00  0.00           O  
HETATM   30  H   UNL     1       0.079   3.998  -1.324  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.171   2.767  -1.145  1.00  0.00           H  
HETATM   32  H   UNL     1       2.774  -1.013   0.228  1.00  0.00           H  
HETATM   33  H   UNL     1       1.771  -0.316   1.522  1.00  0.00           H  
HETATM   34  H   UNL     1      -5.983   0.190   1.250  1.00  0.00           H  
HETATM   35  H   UNL     1      -3.789  -2.057  -1.659  1.00  0.00           H  
HETATM   36  H   UNL     1      -1.751   1.497   2.818  1.00  0.00           H  
HETATM   37  H   UNL     1      -0.013   1.341   2.463  1.00  0.00           H  
HETATM   38  H   UNL     1       5.464   1.416   0.153  1.00  0.00           H  
HETATM   39  H   UNL     1       4.200   0.196  -0.132  1.00  0.00           H  
HETATM   40  H   UNL     1       4.380   1.569  -1.251  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.913  -1.416  -0.571  1.00  0.00           H  
HETATM   42  H   UNL     1      -3.930   1.262   2.099  1.00  0.00           H  
HETATM   43  H   UNL     1       1.815  -4.840   2.768  1.00  0.00           H  
HETATM   44  H   UNL     1       0.179  -4.243   2.402  1.00  0.00           H  
HETATM   45  H   UNL     1       1.183  -4.940   1.108  1.00  0.00           H  
HETATM   46  H   UNL     1       3.853   2.672   1.434  1.00  0.00           H  
HETATM   47  H   UNL     1       1.244  -1.384  -4.344  1.00  0.00           H  
HETATM   48  H   UNL     1      -0.132  -2.336  -3.739  1.00  0.00           H  
HETATM   49  H   UNL     1      -0.421  -0.890  -4.735  1.00  0.00           H  
HETATM   50  H   UNL     1       2.469   0.941  -1.318  1.00  0.00           H  
HETATM   51  H   UNL     1       0.100   1.322  -2.287  1.00  0.00           H  
HETATM   52  H   UNL     1       1.387   2.549  -2.419  1.00  0.00           H  
HETATM   53  H   UNL     1       1.336   3.098   2.137  1.00  0.00           H  
HETATM   54  H   UNL     1      -1.944   3.236   1.028  1.00  0.00           H  
HETATM   55  H   UNL     1      -0.743   3.717   2.264  1.00  0.00           H  
HETATM   56  H   UNL     1      -1.012  -1.445  -1.406  1.00  0.00           H  
CONECT    1   24   20   30   31                                       
CONECT    2   26   27   27   15                                       
CONECT    3   26    4   32   33                                       
CONECT    4   19    3    9   16                                       
CONECT    5   12   13   13   34                                       
CONECT    6   12   12   10   35                                       
CONECT    7   14    9    9    8                                       
CONECT    8   23    7   36   37                                       
CONECT    9   25    7    7    4                                       
CONECT   10    6   25   14   14                                       
CONECT   11   17   38   39   40                                       
CONECT   12    6    6    5   41                                       
CONECT   13    5    5   14   42                                       
CONECT   14   10   10   13    7                                       
CONECT   15    2   43   44   45                                       
CONECT   16    4   28   28   29                                       
CONECT   17   11   21   21   46                                       
CONECT   18   29   47   48   49                                       
CONECT   19   21   20    4   50                                       
CONECT   20   19    1   51   52                                       
CONECT   21   17   17   22   19                                       
CONECT   22   21   24   24   53                                       
CONECT   23   24    8   54   55                                       
CONECT   24   22   22    1   23                                       
CONECT   25   10    9   56                                            
CONECT   26    3    2                                                 
CONECT   27    2    2                                                 
CONECT   28   16   16                                                 
CONECT   29   16   18                                                 
CONECT   30    1                                                      
CONECT   31    1                                                      
CONECT   32    3                                                      
CONECT   33    3                                                      
CONECT   34    5                                                      
CONECT   35    6                                                      
CONECT   36    8                                                      
CONECT   37    8                                                      
CONECT   38   11                                                      
CONECT   39   11                                                      
CONECT   40   11                                                      
CONECT   41   12                                                      
CONECT   42   13                                                      
CONECT   43   15                                                      
CONECT   44   15                                                      
CONECT   45   15                                                      
CONECT   46   17                                                      
CONECT   47   18                                                      
CONECT   48   18                                                      
CONECT   49   18                                                      
CONECT   50   19                                                      
CONECT   51   20                                                      
CONECT   52   20                                                      
CONECT   53   22                                                      
CONECT   54   23                                                      
CONECT   55   23                                                      
CONECT   56   25                                                      
MASTER        0    0    0    0    0    0    0    0   56    0   56    0
END
