COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNK A   1      -1.605   0.003  -0.414  1.00  0.00           C  
HETATM    2  C   UNK A   1       8.943   0.530  -0.337  1.00  0.00           C  
HETATM    3  C   UNK A   1       7.615   0.440   0.084  1.00  0.00           C  
HETATM    4  C   UNK A   1      -5.559  -2.725  -0.652  1.00  0.00           C  
HETATM    5  O   UNK A   1      -2.112  -1.192   3.220  1.00  0.00           O  
HETATM    6  C   UNK A   1      -4.919  -1.412  -1.107  1.00  0.00           C  
HETATM    7  O   UNK A   1      -0.664   0.258   2.370  1.00  0.00           O  
HETATM    8  C   UNK A   1       7.024  -0.804   0.237  1.00  0.00           C  
HETATM    9  O   UNK A   1      -5.168  -3.003   0.694  1.00  0.00           O  
HETATM   10  C   UNK A   1      -6.976   1.551   0.046  1.00  0.00           C  
HETATM   11  C   UNK A   1       4.808   0.057   0.319  1.00  0.00           C  
HETATM   12  C   UNK A   1      -5.480  -0.272  -0.297  1.00  0.00           C  
HETATM   13  C   UNK A   1       1.100  -0.354   0.371  1.00  0.00           C  
HETATM   14  C   UNK A   1       9.582   1.852  -0.496  1.00  0.00           C  
HETATM   15  C   UNK A   1      -1.583  -0.513   2.184  1.00  0.00           C  
HETATM   16  C   UNK A   1       9.068  -1.868  -0.446  1.00  0.00           C  
HETATM   17  C   UNK A   1       7.754  -1.957  -0.029  1.00  0.00           C  
HETATM   18  C   UNK A   1       9.666  -0.634  -0.601  1.00  0.00           C  
HETATM   19  C   UNK A   1      -5.093  -3.862  -1.563  1.00  0.00           C  
HETATM   20  C   UNK A   0      -3.404  -1.485  -0.904  1.00  0.00           C  
HETATM   21  C   UNK A   1      -2.123  -0.707   0.817  1.00  0.00           C  
HETATM   22  C   UNK A   1       1.349   1.167   0.450  1.00  0.00           C  
HETATM   23  C   UNK A   1       3.414   0.033   0.892  1.00  0.00           C  
HETATM   24  O   UNK A   1       5.133   0.939  -0.449  1.00  0.00           O  
HETATM   25  O   UNK A   1       8.950   2.864  -0.265  1.00  0.00           O  
HETATM   26  O   UNK A   1      -5.026  -0.025   0.795  1.00  0.00           O  
HETATM   27  O   UNK A   1      -6.485   0.470  -0.789  1.00  0.00           O  
HETATM   28  C   UNK A   1      -8.113   2.278  -0.677  1.00  0.00           C  
HETATM   29  C   UNK A   1      -8.540   3.474   0.134  1.00  0.00           C  
HETATM   30  O   UNK A   1      -9.676   3.558   0.535  1.00  0.00           O  
HETATM   31  N   UNK A   1      -9.252   1.365  -0.840  1.00  0.00           N  
HETATM   32  N   UNK A   1      -3.082  -1.493   0.528  1.00  0.00           N  
HETATM   33  S   UNK A   1      -0.051  -0.746  -0.975  1.00  0.00           S  
HETATM   34  N   UNK A   1       2.778   1.360   0.755  1.00  0.00           N  
HETATM   35  N   UNK A   1       5.694  -0.900   0.660  1.00  0.00           N  
HETATM   36  O   UNK A   1      10.865   1.936  -0.897  1.00  0.00           O  
HETATM   37  C   UNK A   1       2.512  -0.924   0.073  1.00  0.00           C  
HETATM   38  C   UNK A   1      -2.725  -0.212  -1.461  1.00  0.00           C  
HETATM   39  C   UNK A   1      -3.697   0.970  -1.480  1.00  0.00           C  
HETATM   40  H   UNK A   1      -1.467   1.065  -0.214  1.00  0.00           H  
HETATM   41  H   UNK A   1       7.050   1.337   0.291  1.00  0.00           H  
HETATM   42  H   UNK A   1      -6.644  -2.638  -0.704  1.00  0.00           H  
HETATM   43  H   UNK A   1      -1.727  -1.032   4.092  1.00  0.00           H  
HETATM   44  H   UNK A   1      -5.136  -1.249  -2.163  1.00  0.00           H  
HETATM   45  H   UNK A   1      -4.228  -3.209   0.797  1.00  0.00           H  
HETATM   46  H   UNK A   1      -7.346   1.145   0.987  1.00  0.00           H  
HETATM   47  H   UNK A   1      -6.166   2.252   0.246  1.00  0.00           H  
HETATM   48  H   UNK A   1       0.724  -0.733   1.321  1.00  0.00           H  
HETATM   49  H   UNK A   1       9.630  -2.768  -0.650  1.00  0.00           H  
HETATM   50  H   UNK A   1       7.292  -2.926   0.091  1.00  0.00           H  
HETATM   51  H   UNK A   1      10.694  -0.569  -0.927  1.00  0.00           H  
HETATM   52  H   UNK A   1      -5.549  -4.798  -1.239  1.00  0.00           H  
HETATM   53  H   UNK A   1      -5.391  -3.650  -2.590  1.00  0.00           H  
HETATM   54  H   UNK A   1      -4.008  -3.949  -1.511  1.00  0.00           H  
HETATM   55  H   UNK A   0      -3.000  -2.374  -1.387  1.00  0.00           H  
HETATM   56  H   UNK A   1       1.108   1.632  -0.506  1.00  0.00           H  
HETATM   57  H   UNK A   1       0.738   1.602   1.241  1.00  0.00           H  
HETATM   58  H   UNK A   1       3.440  -0.270   1.939  1.00  0.00           H  
HETATM   59  H   UNK A   1      -7.768   2.608  -1.656  1.00  0.00           H  
HETATM   60  H   UNK A   1      -7.829   4.257   0.357  1.00  0.00           H  
HETATM   61  H   UNK A   1      -9.009   0.587  -1.434  1.00  0.00           H  
HETATM   62  H   UNK A   1      -9.590   1.045   0.055  1.00  0.00           H  
HETATM   63  H   UNK A   1       2.898   1.906   1.595  1.00  0.00           H  
HETATM   64  H   UNK A   1       5.409  -1.655   1.197  1.00  0.00           H  
HETATM   65  H   UNK A   1      11.240   2.823  -0.987  1.00  0.00           H  
HETATM   66  H   UNK A   1       2.602  -1.949   0.433  1.00  0.00           H  
HETATM   67  H   UNK A   1       2.742  -0.863  -0.990  1.00  0.00           H  
HETATM   68  H   UNK A   1      -2.308  -0.391  -2.452  1.00  0.00           H  
HETATM   69  H   UNK A   1      -4.012   1.197  -0.461  1.00  0.00           H  
HETATM   70  H   UNK A   1      -3.203   1.840  -1.910  1.00  0.00           H  
HETATM   71  H   UNK A   1      -4.570   0.713  -2.081  1.00  0.00           H  
CONECT    1   38   33   21   40                                       
CONECT    2    3   14   18   18                                       
CONECT    3    8    8    2   41                                       
CONECT    4   19    9    6   42                                       
CONECT    5   15   43                                                 
CONECT    6    4   20   12   44                                       
CONECT    7   15   15                                                 
CONECT    8   35    3    3   17                                       
CONECT    9    4   45                                                 
CONECT   10   27   28   46   47                                       
CONECT   11   24   24   35   23                                       
CONECT   12    6   26   26   27                                       
CONECT   13   33   37   22   48                                       
CONECT   14   25   25    2   36                                       
CONECT   15   21    7    7    5                                       
CONECT   16   17   17   18   49                                       
CONECT   17    8   16   16   50                                       
CONECT   18    2    2   16   51                                       
CONECT   19    4   52   53   54                                       
CONECT   20   38    6   32   55                                       
CONECT   21    1   32   32   15                                       
CONECT   22   13   34   56   57                                       
CONECT   23   11   37   34   58                                       
CONECT   24   11   11                                                 
CONECT   25   14   14                                                 
CONECT   26   12   12                                                 
CONECT   27   12   10                                                 
CONECT   28   10   31   29   59                                       
CONECT   29   28   30   30   60                                       
CONECT   30   29   29                                                 
CONECT   31   28   61   62                                            
CONECT   32   20   21   21                                            
CONECT   33    1   13                                                 
CONECT   34   23   22   63                                            
CONECT   35   11    8   64                                            
CONECT   36   14   65                                                 
CONECT   37   23   13   66   67                                       
CONECT   38   39   20    1   68                                       
CONECT   39   38   69   70   71                                       
CONECT   40    1                                                      
CONECT   41    3                                                      
CONECT   42    4                                                      
CONECT   43    5                                                      
CONECT   44    6                                                      
CONECT   45    9                                                      
CONECT   46   10                                                      
CONECT   47   10                                                      
CONECT   48   13                                                      
CONECT   49   16                                                      
CONECT   50   17                                                      
CONECT   51   18                                                      
CONECT   52   19                                                      
CONECT   53   19                                                      
CONECT   54   19                                                      
CONECT   55   20                                                      
CONECT   56   22                                                      
CONECT   57   22                                                      
CONECT   58   23                                                      
CONECT   59   28                                                      
CONECT   60   29                                                      
CONECT   61   31                                                      
CONECT   62   31                                                      
CONECT   63   34                                                      
CONECT   64   35                                                      
CONECT   65   36                                                      
CONECT   66   37                                                      
CONECT   67   37                                                      
CONECT   68   38                                                      
CONECT   69   39                                                      
CONECT   70   39                                                      
CONECT   71   39                                                      
MASTER        0    0    0    0    0    0    0    0   71    0   71    0
END
