COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.989  -1.653  -0.360  1.00  0.00           C  
HETATM    2  C   UNL     1       1.944  -0.242   0.231  1.00  0.00           C  
HETATM    3  C   UNL     1      -0.320   0.541  -0.215  1.00  0.00           C  
HETATM    4  C   UNL     1       2.856  -2.532   0.504  1.00  0.00           C  
HETATM    5  C   UNL     1       3.314   0.380   0.149  1.00  0.00           C  
HETATM    6  C   UNL     1      -1.300   1.380  -0.993  1.00  0.00           C  
HETATM    7  C   UNL     1      -2.689   1.163  -0.450  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.440   1.758   1.064  1.00  0.00           C  
HETATM    9  C   UNL     1      -3.485   0.161  -0.965  1.00  0.00           C  
HETATM   10  C   UNL     1      -3.168   1.965   0.570  1.00  0.00           C  
HETATM   11  C   UNL     1      -4.767  -0.046  -0.471  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.244   0.751   0.544  1.00  0.00           C  
HETATM   13  C   UNL     1      -6.616   0.572   1.139  1.00  0.00           C  
HETATM   14  C   UNL     1      -7.504  -0.247   0.205  1.00  0.00           C  
HETATM   15  C   UNL     1      -6.752  -1.527  -0.178  1.00  0.00           C  
HETATM   16  C   UNL     1      -5.587  -1.148  -1.089  1.00  0.00           C  
HETATM   17  C   UNL     1       4.123   0.419   1.270  1.00  0.00           C  
HETATM   18  C   UNL     1       5.379   0.990   1.195  1.00  0.00           C  
HETATM   19  C   UNL     1       5.827   1.522   0.000  1.00  0.00           C  
HETATM   20  C   UNL     1       5.018   1.483  -1.120  1.00  0.00           C  
HETATM   21  C   UNL     1       3.763   0.908  -1.047  1.00  0.00           C  
HETATM   22  C   UNL     1       7.197   2.145  -0.081  1.00  0.00           C  
HETATM   23  C   UNL     1       2.569  -1.595  -1.774  1.00  0.00           C  
HETATM   24  N   UNL     1       0.991   0.573  -0.526  1.00  0.00           N  
HETATM   25  O   UNL     1       3.157  -3.778   0.105  1.00  0.00           O  
HETATM   26  O   UNL     1      -0.711  -0.164   0.692  1.00  0.00           O  
HETATM   27  O   UNL     1       3.281  -2.115   1.555  1.00  0.00           O  
HETATM   28  H   UNL     1       0.980  -2.063  -0.398  1.00  0.00           H  
HETATM   29  H   UNL     1       1.630  -0.295   1.273  1.00  0.00           H  
HETATM   30  H   UNL     1      -1.033   2.433  -0.898  1.00  0.00           H  
HETATM   31  H   UNL     1      -1.272   1.092  -2.044  1.00  0.00           H  
HETATM   32  H   UNL     1      -4.813   2.384   1.860  1.00  0.00           H  
HETATM   33  H   UNL     1      -3.109  -0.467  -1.759  1.00  0.00           H  
HETATM   34  H   UNL     1      -2.549   2.750   0.978  1.00  0.00           H  
HETATM   35  H   UNL     1      -6.529   0.057   2.096  1.00  0.00           H  
HETATM   36  H   UNL     1      -7.069   1.551   1.299  1.00  0.00           H  
HETATM   37  H   UNL     1      -8.433  -0.504   0.713  1.00  0.00           H  
HETATM   38  H   UNL     1      -7.724   0.332  -0.692  1.00  0.00           H  
HETATM   39  H   UNL     1      -6.372  -2.012   0.722  1.00  0.00           H  
HETATM   40  H   UNL     1      -7.425  -2.205  -0.703  1.00  0.00           H  
HETATM   41  H   UNL     1      -5.977  -0.811  -2.049  1.00  0.00           H  
HETATM   42  H   UNL     1      -4.954  -2.022  -1.246  1.00  0.00           H  
HETATM   43  H   UNL     1       3.773   0.003   2.203  1.00  0.00           H  
HETATM   44  H   UNL     1       6.011   1.021   2.070  1.00  0.00           H  
HETATM   45  H   UNL     1       5.368   1.899  -2.053  1.00  0.00           H  
HETATM   46  H   UNL     1       3.133   0.873  -1.923  1.00  0.00           H  
HETATM   47  H   UNL     1       7.926   1.384  -0.356  1.00  0.00           H  
HETATM   48  H   UNL     1       7.193   2.934  -0.833  1.00  0.00           H  
HETATM   49  H   UNL     1       7.461   2.568   0.888  1.00  0.00           H  
HETATM   50  H   UNL     1       3.579  -1.185  -1.736  1.00  0.00           H  
HETATM   51  H   UNL     1       2.602  -2.601  -2.195  1.00  0.00           H  
HETATM   52  H   UNL     1       1.942  -0.960  -2.399  1.00  0.00           H  
HETATM   53  H   UNL     1       1.303   1.137  -1.251  1.00  0.00           H  
HETATM   54  H   UNL     1       3.716  -4.304   0.693  1.00  0.00           H  
CONECT    1    4   23    2   28                                       
CONECT    2    1   24    5   29                                       
CONECT    3    6   24   26   26                                       
CONECT    4   27   27   25    1                                       
CONECT    5    2   17   17   21                                       
CONECT    6    3    7   30   31                                       
CONECT    7    6    9    9   10                                       
CONECT    8   10   10   12   32                                       
CONECT    9    7    7   11   33                                       
CONECT   10    7    8    8   34                                       
CONECT   11    9   16   12   12                                       
CONECT   12   11   11    8   13                                       
CONECT   13   12   14   35   36                                       
CONECT   14   15   13   37   38                                       
CONECT   15   16   14   39   40                                       
CONECT   16   11   15   41   42                                       
CONECT   17    5    5   18   43                                       
CONECT   18   17   19   19   44                                       
CONECT   19   18   18   20   22                                       
CONECT   20   21   21   19   45                                       
CONECT   21    5   20   20   46                                       
CONECT   22   19   47   48   49                                       
CONECT   23    1   50   51   52                                       
CONECT   24    3    2   53                                            
CONECT   25    4   54                                                 
CONECT   26    3    3                                                 
CONECT   27    4    4                                                 
CONECT   28    1                                                      
CONECT   29    2                                                      
CONECT   30    6                                                      
CONECT   31    6                                                      
CONECT   32    8                                                      
CONECT   33    9                                                      
CONECT   34   10                                                      
CONECT   35   13                                                      
CONECT   36   13                                                      
CONECT   37   14                                                      
CONECT   38   14                                                      
CONECT   39   15                                                      
CONECT   40   15                                                      
CONECT   41   16                                                      
CONECT   42   16                                                      
CONECT   43   17                                                      
CONECT   44   18                                                      
CONECT   45   20                                                      
CONECT   46   21                                                      
CONECT   47   22                                                      
CONECT   48   22                                                      
CONECT   49   22                                                      
CONECT   50   23                                                      
CONECT   51   23                                                      
CONECT   52   23                                                      
CONECT   53   24                                                      
CONECT   54   25                                                      
MASTER        0    0    0    0    0    0    0    0   54    0   54    0
END
