COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1       1.636   2.106   0.739  1.00  0.00           C  
HETATM    2  C   UNL     1       1.636   0.645   0.371  1.00  0.00           C  
HETATM    3  N   UNL     1      -9.564   3.749   0.022  1.00  0.00           N  
HETATM    4  C   UNL     1       2.820  -1.325  -0.340  1.00  0.00           C  
HETATM    5  N   UNL     1       5.237  -1.194   0.390  1.00  0.00           N  
HETATM    6  C   UNL     1       0.457  -1.421   0.059  1.00  0.00           C  
HETATM    7  C   UNL     1       0.457  -0.074   0.398  1.00  0.00           C  
HETATM    8  C   UNL     1      -4.385  -1.658  -0.389  1.00  0.00           C  
HETATM    9  C   UNL     1      -5.575  -2.357  -0.259  1.00  0.00           C  
HETATM   10  C   UNL     1      -6.975  -0.433  -0.288  1.00  0.00           C  
HETATM   11  C   UNL     1      -8.316   0.209  -0.530  1.00  0.00           C  
HETATM   12  C   UNL     1      -8.258   1.683  -0.123  1.00  0.00           C  
HETATM   13  C   UNL     1      -9.620   2.334  -0.368  1.00  0.00           C  
HETATM   14  C   UNL     1     -10.770   4.465  -0.415  1.00  0.00           C  
HETATM   15  C   UNL     1      -9.367   3.888   1.472  1.00  0.00           C  
HETATM   16  C   UNL     1       5.228   0.101   0.108  1.00  0.00           C  
HETATM   17  C   UNL     1       6.377  -1.852   0.533  1.00  0.00           C  
HETATM   18  C   UNL     1       7.573  -1.174   0.385  1.00  0.00           C  
HETATM   19  C   UNL     1       7.533   0.191   0.088  1.00  0.00           C  
HETATM   20  C   UNL     1       8.788   0.963  -0.080  1.00  0.00           C  
HETATM   21  C   UNL     1       8.751   2.348  -0.268  1.00  0.00           C  
HETATM   22  C   UNL     1       2.820   0.022   0.000  1.00  0.00           C  
HETATM   23  C   UNL     1       1.643  -2.045  -0.308  1.00  0.00           C  
HETATM   24  N   UNL     1      -0.738  -2.149   0.087  1.00  0.00           N  
HETATM   25  C   UNL     1      -1.904  -1.543  -0.214  1.00  0.00           C  
HETATM   26  O   UNL     1      -1.909  -0.389  -0.596  1.00  0.00           O  
HETATM   27  C   UNL     1      -3.178  -2.282  -0.079  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.563  -3.673   0.184  1.00  0.00           C  
HETATM   29  C   UNL     1      -4.366  -4.291   0.497  1.00  0.00           C  
HETATM   30  C   UNL     1      -3.175  -3.608   0.360  1.00  0.00           C  
HETATM   31  N   UNL     1      -6.789  -1.736  -0.575  1.00  0.00           N  
HETATM   32  O   UNL     1      -6.061   0.224   0.166  1.00  0.00           O  
HETATM   33  N   UNL     1       4.014   0.752  -0.034  1.00  0.00           N  
HETATM   34  N   UNL     1       6.350   0.788  -0.041  1.00  0.00           N  
HETATM   35  C   UNL     1      10.024   0.320  -0.049  1.00  0.00           C  
HETATM   36  N   UNL     1      11.139   1.005  -0.198  1.00  0.00           N  
HETATM   37  C   UNL     1      11.135   2.311  -0.382  1.00  0.00           C  
HETATM   38  C   UNL     1       9.950   3.022  -0.420  1.00  0.00           C  
HETATM   39  H   UNL     1       1.458   2.705  -0.154  1.00  0.00           H  
HETATM   40  H   UNL     1       0.849   2.297   1.468  1.00  0.00           H  
HETATM   41  H   UNL     1       2.602   2.372   1.169  1.00  0.00           H  
HETATM   42  H   UNL     1       3.742  -1.810  -0.625  1.00  0.00           H  
HETATM   43  H   UNL     1      -0.465   0.411   0.684  1.00  0.00           H  
HETATM   44  H   UNL     1      -4.393  -0.634  -0.733  1.00  0.00           H  
HETATM   45  H   UNL     1      -8.570   0.134  -1.587  1.00  0.00           H  
HETATM   46  H   UNL     1      -9.076  -0.301   0.063  1.00  0.00           H  
HETATM   47  H   UNL     1      -8.005   1.758   0.935  1.00  0.00           H  
HETATM   48  H   UNL     1      -7.499   2.194  -0.715  1.00  0.00           H  
HETATM   49  H   UNL     1     -10.379   1.824   0.224  1.00  0.00           H  
HETATM   50  H   UNL     1      -9.873   2.259  -1.426  1.00  0.00           H  
HETATM   51  H   UNL     1     -10.702   5.510  -0.113  1.00  0.00           H  
HETATM   52  H   UNL     1     -10.854   4.405  -1.501  1.00  0.00           H  
HETATM   53  H   UNL     1     -11.649   4.010   0.043  1.00  0.00           H  
HETATM   54  H   UNL     1     -10.228   3.475   1.997  1.00  0.00           H  
HETATM   55  H   UNL     1      -8.467   3.349   1.769  1.00  0.00           H  
HETATM   56  H   UNL     1      -9.259   4.943   1.724  1.00  0.00           H  
HETATM   57  H   UNL     1       6.372  -2.908   0.762  1.00  0.00           H  
HETATM   58  H   UNL     1       8.517  -1.687   0.497  1.00  0.00           H  
HETATM   59  H   UNL     1       7.810   2.878  -0.293  1.00  0.00           H  
HETATM   60  H   UNL     1       1.643  -3.093  -0.568  1.00  0.00           H  
HETATM   61  H   UNL     1      -0.727  -3.090   0.322  1.00  0.00           H  
HETATM   62  H   UNL     1      -6.491  -4.216   0.285  1.00  0.00           H  
HETATM   63  H   UNL     1      -4.363  -5.315   0.842  1.00  0.00           H  
HETATM   64  H   UNL     1      -2.242  -4.095   0.601  1.00  0.00           H  
HETATM   65  H   UNL     1      -7.497  -2.244  -1.001  1.00  0.00           H  
HETATM   66  H   UNL     1       3.991   1.714  -0.155  1.00  0.00           H  
HETATM   67  H   UNL     1      10.068  -0.749   0.100  1.00  0.00           H  
HETATM   68  H   UNL     1      12.073   2.834  -0.500  1.00  0.00           H  
HETATM   69  H   UNL     1       9.959   4.091  -0.572  1.00  0.00           H  
CONECT    1    2   39   40   41                                       
CONECT    2    1   22   22    7                                       
CONECT    3   13   14   15                                            
CONECT    4   22   23   23   42                                       
CONECT    5   16   16   17                                            
CONECT    6   23    7    7   24                                       
CONECT    7    2    6    6   43                                       
CONECT    8   27   27    9   44                                       
CONECT    9    8   28   28   31                                       
CONECT   10   31   32   32   11                                       
CONECT   11   10   12   45   46                                       
CONECT   12   11   13   47   48                                       
CONECT   13   12    3   49   50                                       
CONECT   14    3   51   52   53                                       
CONECT   15    3   54   55   56                                       
CONECT   16   33    5    5   34                                       
CONECT   17    5   18   18   57                                       
CONECT   18   17   17   19   58                                       
CONECT   19   18   34   34   20                                       
CONECT   20   19   35   35   21                                       
CONECT   21   20   38   38   59                                       
CONECT   22    2    2    4   33                                       
CONECT   23    4    4    6   60                                       
CONECT   24    6   25   61                                            
CONECT   25   24   26   26   27                                       
CONECT   26   25   25                                                 
CONECT   27   25    8    8   30                                       
CONECT   28    9    9   29   62                                       
CONECT   29   28   30   30   63                                       
CONECT   30   27   29   29   64                                       
CONECT   31    9   10   65                                            
CONECT   32   10   10                                                 
CONECT   33   22   16   66                                            
CONECT   34   16   19   19                                            
CONECT   35   20   20   36   67                                       
CONECT   36   35   37   37                                            
CONECT   37   36   36   38   68                                       
CONECT   38   37   21   21   69                                       
CONECT   39    1                                                      
CONECT   40    1                                                      
CONECT   41    1                                                      
CONECT   42    4                                                      
CONECT   43    7                                                      
CONECT   44    8                                                      
CONECT   45   11                                                      
CONECT   46   11                                                      
CONECT   47   12                                                      
CONECT   48   12                                                      
CONECT   49   13                                                      
CONECT   50   13                                                      
CONECT   51   14                                                      
CONECT   52   14                                                      
CONECT   53   14                                                      
CONECT   54   15                                                      
CONECT   55   15                                                      
CONECT   56   15                                                      
CONECT   57   17                                                      
CONECT   58   18                                                      
CONECT   59   21                                                      
CONECT   60   23                                                      
CONECT   61   24                                                      
CONECT   62   28                                                      
CONECT   63   29                                                      
CONECT   64   30                                                      
CONECT   65   31                                                      
CONECT   66   33                                                      
CONECT   67   35                                                      
CONECT   68   37                                                      
CONECT   69   38                                                      
MASTER        0    0    0    0    0    0    0    0   69    0   69    0
END
