REMARK  Name = BDB062485
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.189  -1.220   0.982  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1       -0.194   0.134   0.523  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -1.515   0.231  -0.278  0.00  0.00    +0.120 C 
ATOM      4  N   LIG    1       -2.641  -0.355   0.469  0.00  0.00    -0.326 N 
ATOM      5  C   LIG    1       -2.296  -1.341   1.506  0.00  0.00    +0.120 C 
ATOM      6  C   LIG    1       -1.000  -2.091   1.125  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.940   0.084   0.286  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1       -4.963  -0.118   1.219  0.00  0.00    +0.134 A 
ATOM      9  N   LIG    1       -6.257   0.281   1.091  0.00  0.00    -0.256 NA
ATOM     10  C   LIG    1       -6.598   0.931  -0.048  0.00  0.00    +0.067 A 
ATOM     11  C   LIG    1       -5.664   1.192  -1.043  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1       -4.344   0.764  -0.868  0.00  0.00    +0.026 A 
BRANCH  10  13
ATOM     13  C   LIG    1       -8.048   1.379  -0.197  0.00  0.00    +0.205 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -8.796   0.397  -1.135  0.00  0.00    +0.410 C 
ATOM     15  F   LIG    1       -8.868  -0.855  -0.629  0.00  0.00    -0.169 F 
ATOM     16  F   LIG    1      -10.068   0.813  -1.362  0.00  0.00    -0.169 F 
ATOM     17  F   LIG    1       -8.199   0.317  -2.350  0.00  0.00    -0.169 F 
ENDBRANCH  13  14
BRANCH  13  18
ATOM     18  N   LIG    1       -8.678   1.587   1.150  0.00  0.00    -0.315 NA
ATOM     19  H   LIG    1       -8.642   0.674   1.616  0.00  0.00    +0.119 HD
ATOM     20  H   LIG    1       -8.023   2.147   1.700  0.00  0.00    +0.119 HD
ENDBRANCH  13  18
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1        1.188  -1.862   0.117  0.00  0.00    +0.121 C 
BRANCH  21  31
ATOM     22  C   LIG    1        7.117   0.790  -0.408  0.00  0.00    +0.019 A 
ATOM     23  C   LIG    1        6.549   0.629  -1.788  0.00  0.00    +0.252 A 
ATOM     24  O   LIG    1        7.169   0.972  -2.790  0.00  0.00    -0.268 OA
ATOM     25  N   LIG    1        5.296   0.079  -1.888  0.00  0.00    -0.321 N 
ATOM     26  H   LIG    1        4.934  -0.025  -2.825  0.00  0.00    +0.169 HD
ATOM     27  C   LIG    1        4.542  -0.314  -0.777  0.00  0.00    +0.068 A 
ATOM     28  C   LIG    1        5.060  -0.154   0.506  0.00  0.00    +0.088 A 
ATOM     29  N   LIG    1        4.402  -0.506   1.630  0.00  0.00    -0.253 NA
ATOM     30  C   LIG    1        3.168  -1.038   1.458  0.00  0.00    +0.116 A 
ATOM     31  C   LIG    1        2.556  -1.234   0.218  0.00  0.00    -0.013 A 
ATOM     32  C   LIG    1        3.274  -0.865  -0.926  0.00  0.00    +0.034 A 
ATOM     33  C   LIG    1        6.390   0.424   0.662  0.00  0.00    +0.038 A 
BRANCH  22  35
ATOM     34  C   LIG    1        9.592   0.409  -0.619  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1        8.486   1.403  -0.294  0.00  0.00    +0.037 C 
ENDBRANCH  22  35
ENDBRANCH  21  31
ENDBRANCH   1  21
TORSDOF 7