COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  C   UNL     1      11.547  -4.913   0.435  1.00  0.00           C  
HETATM    2  C   UNL     1     -11.384   5.836   1.150  1.00  0.00           C  
HETATM    3  C   UNL     1       8.587   6.693   0.425  1.00  0.00           C  
HETATM    4  C   UNL     1      -6.855  -9.074  -2.336  1.00  0.00           C  
HETATM    5  O   UNL     1       0.464   3.889  -1.583  1.00  0.00           O  
HETATM    6  O   UNL     1      -0.734  -3.794   1.384  1.00  0.00           O  
HETATM    7  O   UNL     1       3.754   0.930  -1.263  1.00  0.00           O  
HETATM    8  O   UNL     1      -4.021  -0.832   1.074  1.00  0.00           O  
HETATM    9  C   UNL     1      -1.479   2.135  -0.527  1.00  0.00           C  
HETATM   10  C   UNL     1       1.212  -2.037   0.340  1.00  0.00           C  
HETATM   11  C   UNL     1       5.432  -2.845  -0.147  1.00  0.00           C  
HETATM   12  C   UNL     1      -5.691   2.958   0.002  1.00  0.00           C  
HETATM   13  C   UNL     1       3.674   4.210  -0.847  1.00  0.00           C  
HETATM   14  C   UNL     1      -3.942  -4.110   0.645  1.00  0.00           C  
HETATM   15  C   UNL     1       3.937  -2.722   0.153  1.00  0.00           C  
HETATM   16  C   UNL     1      -4.200   2.830  -0.314  1.00  0.00           C  
HETATM   17  C   UNL     1       5.946  -4.192   0.366  1.00  0.00           C  
HETATM   18  C   UNL     1      -6.206   4.306  -0.507  1.00  0.00           C  
HETATM   19  C   UNL     1       4.651   5.233  -1.428  1.00  0.00           C  
HETATM   20  C   UNL     1      -4.921  -5.135   1.220  1.00  0.00           C  
HETATM   21  C   UNL     1       9.337  -5.777  -0.049  1.00  0.00           C  
HETATM   22  C   UNL     1       9.633  -3.430   0.463  1.00  0.00           C  
HETATM   23  C   UNL     1      -9.726   5.644  -0.604  1.00  0.00           C  
HETATM   24  C   UNL     1      -9.369   4.546   1.523  1.00  0.00           C  
HETATM   25  C   UNL     1       6.545   7.990   0.304  1.00  0.00           C  
HETATM   26  C   UNL     1       6.635   6.000   1.680  1.00  0.00           C  
HETATM   27  C   UNL     1      -7.272  -7.470  -0.570  1.00  0.00           C  
HETATM   28  C   UNL     1      -5.146  -7.470  -1.727  1.00  0.00           C  
HETATM   29  C   UNL     1       7.860  -5.675   0.337  1.00  0.00           C  
HETATM   30  C   UNL     1       8.156  -3.328   0.850  1.00  0.00           C  
HETATM   31  C   UNL     1      -8.221   5.596  -0.881  1.00  0.00           C  
HETATM   32  C   UNL     1      -7.865   4.498   1.247  1.00  0.00           C  
HETATM   33  C   UNL     1       6.008   7.158  -0.863  1.00  0.00           C  
HETATM   34  C   UNL     1       6.097   5.169   0.513  1.00  0.00           C  
HETATM   35  C   UNL     1      -6.630  -6.739   0.611  1.00  0.00           C  
HETATM   36  C   UNL     1      -4.504  -6.739  -0.545  1.00  0.00           C  
HETATM   37  C   UNL     1       3.052   3.396  -1.983  1.00  0.00           C  
HETATM   38  C   UNL     1      -3.321  -3.300   1.785  1.00  0.00           C  
HETATM   39  N   UNL     1       3.445  -1.432  -0.337  1.00  0.00           N  
HETATM   40  N   UNL     1      -3.707   1.539   0.174  1.00  0.00           N  
HETATM   41  C   UNL     1       2.111  -1.094  -0.178  1.00  0.00           C  
HETATM   42  C   UNL     1      -2.376   1.196   0.001  1.00  0.00           C  
HETATM   43  C   UNL     1       0.827   2.773  -1.266  1.00  0.00           C  
HETATM   44  C   UNL     1      -1.095  -2.676   1.074  1.00  0.00           C  
HETATM   45  C   UNL     1       2.579   1.196  -1.096  1.00  0.00           C  
HETATM   46  C   UNL     1      -2.846  -1.097   0.907  1.00  0.00           C  
HETATM   47  C   UNL     1      -0.146   1.814  -0.709  1.00  0.00           C  
HETATM   48  C   UNL     1      -0.121  -1.715   0.522  1.00  0.00           C  
HETATM   49  C   UNL     1       1.674   0.183  -0.534  1.00  0.00           C  
HETATM   50  C   UNL     1      -1.940  -0.083   0.352  1.00  0.00           C  
HETATM   51  C   UNL     1       0.314   0.523  -0.352  1.00  0.00           C  
HETATM   52  C   UNL     1      -0.580  -0.422   0.171  1.00  0.00           C  
HETATM   53  N   UNL     1      10.112  -4.795   0.723  1.00  0.00           N  
HETATM   54  N   UNL     1      -9.953   5.713   0.846  1.00  0.00           N  
HETATM   55  N   UNL     1       7.394   7.144   1.155  1.00  0.00           N  
HETATM   56  N   UNL     1      -6.260  -8.297  -1.241  1.00  0.00           N  
HETATM   57  N   UNL     1       7.381  -4.310   0.078  1.00  0.00           N  
HETATM   58  N   UNL     1      -7.638   4.430  -0.204  1.00  0.00           N  
HETATM   59  N   UNL     1       5.248   6.015  -0.337  1.00  0.00           N  
HETATM   60  N   UNL     1      -5.516  -5.912   0.125  1.00  0.00           N  
HETATM   61  N   UNL     1       2.115   2.416  -1.426  1.00  0.00           N  
HETATM   62  N   UNL     1      -2.384  -2.319   1.234  1.00  0.00           N  
HETATM   63  H   UNL     1      11.721  -4.738  -0.627  1.00  0.00           H  
HETATM   64  H   UNL     1      12.097  -4.174   1.019  1.00  0.00           H  
HETATM   65  H   UNL     1      11.890  -5.913   0.699  1.00  0.00           H  
HETATM   66  H   UNL     1     -11.519   5.953   2.225  1.00  0.00           H  
HETATM   67  H   UNL     1     -11.791   6.708   0.636  1.00  0.00           H  
HETATM   68  H   UNL     1     -11.906   4.940   0.813  1.00  0.00           H  
HETATM   69  H   UNL     1       9.166   7.559   0.105  1.00  0.00           H  
HETATM   70  H   UNL     1       9.198   6.069   1.078  1.00  0.00           H  
HETATM   71  H   UNL     1       8.283   6.117  -0.448  1.00  0.00           H  
HETATM   72  H   UNL     1      -7.292  -8.394  -3.068  1.00  0.00           H  
HETATM   73  H   UNL     1      -6.084  -9.677  -2.815  1.00  0.00           H  
HETATM   74  H   UNL     1      -7.632  -9.727  -1.938  1.00  0.00           H  
HETATM   75  H   UNL     1      -1.833   3.119  -0.798  1.00  0.00           H  
HETATM   76  H   UNL     1       1.566  -3.020   0.610  1.00  0.00           H  
HETATM   77  H   UNL     1       5.593  -2.780  -1.222  1.00  0.00           H  
HETATM   78  H   UNL     1       5.970  -2.038   0.351  1.00  0.00           H  
HETATM   79  H   UNL     1      -6.237   2.152  -0.487  1.00  0.00           H  
HETATM   80  H   UNL     1      -5.841   2.897   1.080  1.00  0.00           H  
HETATM   81  H   UNL     1       4.207   3.542  -0.170  1.00  0.00           H  
HETATM   82  H   UNL     1       2.887   4.729  -0.299  1.00  0.00           H  
HETATM   83  H   UNL     1      -3.155  -4.627   0.096  1.00  0.00           H  
HETATM   84  H   UNL     1      -4.473  -3.439  -0.030  1.00  0.00           H  
HETATM   85  H   UNL     1       3.399  -3.529  -0.345  1.00  0.00           H  
HETATM   86  H   UNL     1       3.775  -2.787   1.229  1.00  0.00           H  
HETATM   87  H   UNL     1      -4.050   2.892  -1.392  1.00  0.00           H  
HETATM   88  H   UNL     1      -3.654   3.636   0.175  1.00  0.00           H  
HETATM   89  H   UNL     1       5.784  -4.257   1.442  1.00  0.00           H  
HETATM   90  H   UNL     1       5.408  -4.999  -0.132  1.00  0.00           H  
HETATM   91  H   UNL     1      -5.660   5.112  -0.018  1.00  0.00           H  
HETATM   92  H   UNL     1      -6.057   4.368  -1.585  1.00  0.00           H  
HETATM   93  H   UNL     1       5.438   4.714  -1.976  1.00  0.00           H  
HETATM   94  H   UNL     1       4.118   5.901  -2.105  1.00  0.00           H  
HETATM   95  H   UNL     1      -4.389  -5.806   1.895  1.00  0.00           H  
HETATM   96  H   UNL     1      -5.708  -4.617   1.769  1.00  0.00           H  
HETATM   97  H   UNL     1       9.702  -6.780   0.170  1.00  0.00           H  
HETATM   98  H   UNL     1       9.450  -5.573  -1.114  1.00  0.00           H  
HETATM   99  H   UNL     1       9.749  -3.199  -0.596  1.00  0.00           H  
HETATM  100  H   UNL     1      10.213  -2.722   1.055  1.00  0.00           H  
HETATM  101  H   UNL     1     -10.156   6.525  -1.082  1.00  0.00           H  
HETATM  102  H   UNL     1     -10.198   4.747  -1.004  1.00  0.00           H  
HETATM  103  H   UNL     1      -9.837   3.636   1.148  1.00  0.00           H  
HETATM  104  H   UNL     1      -9.539   4.626   2.597  1.00  0.00           H  
HETATM  105  H   UNL     1       7.133   8.822  -0.083  1.00  0.00           H  
HETATM  106  H   UNL     1       5.712   8.375   0.891  1.00  0.00           H  
HETATM  107  H   UNL     1       5.802   6.363   2.283  1.00  0.00           H  
HETATM  108  H   UNL     1       7.289   5.382   2.296  1.00  0.00           H  
HETATM  109  H   UNL     1      -8.080  -8.106  -0.208  1.00  0.00           H  
HETATM  110  H   UNL     1      -7.672  -6.741  -1.275  1.00  0.00           H  
HETATM  111  H   UNL     1      -5.521  -6.741  -2.445  1.00  0.00           H  
HETATM  112  H   UNL     1      -4.403  -8.106  -2.208  1.00  0.00           H  
HETATM  113  H   UNL     1       7.280  -6.383  -0.255  1.00  0.00           H  
HETATM  114  H   UNL     1       7.744  -5.906   1.396  1.00  0.00           H  
HETATM  115  H   UNL     1       8.043  -3.532   1.914  1.00  0.00           H  
HETATM  116  H   UNL     1       7.791  -2.324   0.631  1.00  0.00           H  
HETATM  117  H   UNL     1      -8.051   5.516  -1.955  1.00  0.00           H  
HETATM  118  H   UNL     1      -7.753   6.506  -0.505  1.00  0.00           H  
HETATM  119  H   UNL     1      -7.393   5.396   1.646  1.00  0.00           H  
HETATM  120  H   UNL     1      -7.435   3.618   1.724  1.00  0.00           H  
HETATM  121  H   UNL     1       5.354   7.776  -1.479  1.00  0.00           H  
HETATM  122  H   UNL     1       6.840   6.796  -1.465  1.00  0.00           H  
HETATM  123  H   UNL     1       6.931   4.784  -0.074  1.00  0.00           H  
HETATM  124  H   UNL     1       5.510   4.336   0.900  1.00  0.00           H  
HETATM  125  H   UNL     1      -7.372  -6.103   1.092  1.00  0.00           H  
HETATM  126  H   UNL     1      -6.255  -7.468   1.329  1.00  0.00           H  
HETATM  127  H   UNL     1      -4.104  -7.468   0.160  1.00  0.00           H  
HETATM  128  H   UNL     1      -3.696  -6.103  -0.907  1.00  0.00           H  
HETATM  129  H   UNL     1       2.519   4.064  -2.659  1.00  0.00           H  
HETATM  130  H   UNL     1       3.838   2.876  -2.531  1.00  0.00           H  
HETATM  131  H   UNL     1      -4.109  -2.783   2.333  1.00  0.00           H  
HETATM  132  H   UNL     1      -2.790  -3.972   2.460  1.00  0.00           H  
HETATM  133  H   UNL     1       4.053  -0.815  -0.773  1.00  0.00           H  
HETATM  134  H   UNL     1      -4.312   0.926   0.619  1.00  0.00           H  
CONECT    1   53   63   64   65                                       
CONECT    2   54   66   67   68                                       
CONECT    3   55   69   70   71                                       
CONECT    4   56   72   73   74                                       
CONECT    5   43   43                                                 
CONECT    6   44   44                                                 
CONECT    7   45   45                                                 
CONECT    8   46   46                                                 
CONECT    9   42   42   47   75                                       
CONECT   10   48   48   41   76                                       
CONECT   11   15   17   77   78                                       
CONECT   12   18   16   79   80                                       
CONECT   13   37   19   81   82                                       
CONECT   14   20   38   83   84                                       
CONECT   15   39   11   85   86                                       
CONECT   16   12   40   87   88                                       
CONECT   17   11   57   89   90                                       
CONECT   18   58   12   91   92                                       
CONECT   19   13   59   93   94                                       
CONECT   20   60   14   95   96                                       
CONECT   21   29   53   97   98                                       
CONECT   22   53   30   99  100                                       
CONECT   23   54   31  101  102                                       
CONECT   24   54   32  103  104                                       
CONECT   25   33   55  105  106                                       
CONECT   26   34   55  107  108                                       
CONECT   27   35   56  109  110                                       
CONECT   28   56   36  111  112                                       
CONECT   29   57   21  113  114                                       
CONECT   30   57   22  115  116                                       
CONECT   31   23   58  117  118                                       
CONECT   32   24   58  119  120                                       
CONECT   33   59   25  121  122                                       
CONECT   34   59   26  123  124                                       
CONECT   35   27   60  125  126                                       
CONECT   36   60   28  127  128                                       
CONECT   37   61   13  129  130                                       
CONECT   38   14   62  131  132                                       
CONECT   39   41   15  133                                            
CONECT   40   16   42  134                                            
CONECT   41   49   49   10   39                                       
CONECT   42   40    9    9   50                                       
CONECT   43    5    5   47   61                                       
CONECT   44   62   48    6    6                                       
CONECT   45   61   49    7    7                                       
CONECT   46    8    8   50   62                                       
CONECT   47    9   43   51   51                                       
CONECT   48   52   44   10   10                                       
CONECT   49   51   45   41   41                                       
CONECT   50   42   46   52   52                                       
CONECT   51   47   47   52   49                                       
CONECT   52   50   50   51   48                                       
CONECT   53   21    1   22                                            
CONECT   54    2   24   23                                            
CONECT   55   26   25    3                                            
CONECT   56   27    4   28                                            
CONECT   57   17   29   30                                            
CONECT   58   32   31   18                                            
CONECT   59   19   33   34                                            
CONECT   60   35   20   36                                            
CONECT   61   43   37   45                                            
CONECT   62   46   38   44                                            
CONECT   63    1                                                      
CONECT   64    1                                                      
CONECT   65    1                                                      
CONECT   66    2                                                      
CONECT   67    2                                                      
CONECT   68    2                                                      
CONECT   69    3                                                      
CONECT   70    3                                                      
CONECT   71    3                                                      
CONECT   72    4                                                      
CONECT   73    4                                                      
CONECT   74    4                                                      
CONECT   75    9                                                      
CONECT   76   10                                                      
CONECT   77   11                                                      
CONECT   78   11                                                      
CONECT   79   12                                                      
CONECT   80   12                                                      
CONECT   81   13                                                      
CONECT   82   13                                                      
CONECT   83   14                                                      
CONECT   84   14                                                      
CONECT   85   15                                                      
CONECT   86   15                                                      
CONECT   87   16                                                      
CONECT   88   16                                                      
CONECT   89   17                                                      
CONECT   90   17                                                      
CONECT   91   18                                                      
CONECT   92   18                                                      
CONECT   93   19                                                      
CONECT   94   19                                                      
CONECT   95   20                                                      
CONECT   96   20                                                      
CONECT   97   21                                                      
CONECT   98   21                                                      
CONECT   99   22                                                      
CONECT  100   22                                                      
CONECT  101   23                                                      
CONECT  102   23                                                      
CONECT  103   24                                                      
CONECT  104   24                                                      
CONECT  105   25                                                      
CONECT  106   25                                                      
CONECT  107   26                                                      
CONECT  108   26                                                      
CONECT  109   27                                                      
CONECT  110   27                                                      
CONECT  111   28                                                      
CONECT  112   28                                                      
CONECT  113   29                                                      
CONECT  114   29                                                      
CONECT  115   30                                                      
CONECT  116   30                                                      
CONECT  117   31                                                      
CONECT  118   31                                                      
CONECT  119   32                                                      
CONECT  120   32                                                      
CONECT  121   33                                                      
CONECT  122   33                                                      
CONECT  123   34                                                      
CONECT  124   34                                                      
CONECT  125   35                                                      
CONECT  126   35                                                      
CONECT  127   36                                                      
CONECT  128   36                                                      
CONECT  129   37                                                      
CONECT  130   37                                                      
CONECT  131   38                                                      
CONECT  132   38                                                      
CONECT  133   39                                                      
CONECT  134   40                                                      
MASTER        0    0    0    0    0    0    0    0  134    0  134    0
END
