REMARK  Name = BDB030265
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.577   0.486  -0.010  0.00  0.00    +0.051 C 
ATOM      2  C   LIG    1        2.290  -0.577  -1.046  0.00  0.00    +0.021 C 
ATOM      3  C   LIG    1        1.257  -1.627  -0.807  0.00  0.00    +0.112 C 
ATOM      4  N   LIG    1        0.004  -0.899  -0.688  0.00  0.00    -0.296 N 
ATOM      5  C   LIG    1       -1.168  -1.602  -0.433  0.00  0.00    +0.267 C 
ATOM      6  O   LIG    1       -1.128  -2.824  -0.266  0.00  0.00    -0.268 OA
ATOM      7  C   LIG    1        0.137   0.531  -0.951  0.00  0.00    +0.112 C 
ATOM      8  C   LIG    1        1.605   0.741  -1.139  0.00  0.00    +0.021 C 
ENDROOT
BRANCH   1  14
ATOM      9  C   LIG    1        5.418  -0.824   0.757  0.00  0.00    +0.049 C 
ATOM     10  C   LIG    1        5.177   0.570   0.329  0.00  0.00    +0.021 A 
ATOM     11  C   LIG    1        6.101   1.584   0.165  0.00  0.00    +0.206 A 
ATOM     12  O   LIG    1        5.469   2.717  -0.245  0.00  0.00    -0.353 OA
ATOM     13  N   LIG    1        4.113   2.472  -0.362  0.00  0.00    -0.082 NA
ATOM     14  C   LIG    1        3.958   1.191  -0.025  0.00  0.00    +0.091 A 
BRANCH  11  15
ATOM     15  C   LIG    1        7.561   1.681   0.340  0.00  0.00    +0.409 C 
ATOM     16  F   LIG    1        7.911   1.457   1.637  0.00  0.00    -0.200 F 
ATOM     17  F   LIG    1        8.201   0.724  -0.389  0.00  0.00    -0.200 F 
ENDBRANCH  11  15
ENDBRANCH   1  14
BRANCH   5  18
ATOM     18  C   LIG    1       -2.466  -0.890  -0.361  0.00  0.00    +0.147 A 
ATOM     19  N   LIG    1       -2.645   0.431  -0.552  0.00  0.00    -0.169 NA
ATOM     20  N   LIG    1       -3.963   0.626  -0.395  0.00  0.00    -0.281 N 
ATOM     21  H   LIG    1       -4.323   1.569  -0.496  0.00  0.00    +0.189 HD
ATOM     22  C   LIG    1       -4.662  -0.513  -0.112  0.00  0.00    +0.039 A 
ATOM     23  C   LIG    1       -3.717  -1.514  -0.083  0.00  0.00    +0.057 A 
BRANCH  22  24
ATOM     24  C   LIG    1       -6.144  -0.546   0.104  0.00  0.00    +0.031 C 
ATOM     25  C   LIG    1       -6.899  -0.066  -1.136  0.00  0.00    +0.014 C 
ATOM     26  C   LIG    1       -6.544   0.267   1.335  0.00  0.00    +0.014 C 
ENDBRANCH  22  24
ENDBRANCH   5  18
TORSDOF 4