REMARK  Name = BDB025514
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.881  -1.610  -0.568  0.00  0.00    +0.126 A 
ATOM      2  N   LIG    1       -0.932  -0.661  -0.162  0.00  0.00    -0.185 N 
ATOM      3  C   LIG    1        0.473  -0.803  -0.131  0.00  0.00    +0.257 C 
ATOM      4  O   LIG    1        0.978  -1.859  -0.506  0.00  0.00    -0.270 OA
ATOM      5  N   LIG    1       -1.534   0.515   0.217  0.00  0.00    -0.165 NA
ATOM      6  C   LIG    1       -2.833   0.300   0.004  0.00  0.00    +0.094 A 
ATOM      7  C   LIG    1       -3.920   1.288   0.280  0.00  0.00    +0.217 C 
ATOM      8  O   LIG    1       -5.191   0.878  -0.287  0.00  0.00    -0.373 OA
ATOM      9  C   LIG    1       -5.482  -0.510  -0.031  0.00  0.00    +0.165 C 
ATOM     10  C   LIG    1       -4.490  -1.438  -0.760  0.00  0.00    +0.068 C 
ATOM     11  C   LIG    1       -3.103  -0.997  -0.473  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   3  12
ATOM     12  C   LIG    1        1.228   0.408   0.402  0.00  0.00    +0.113 C 
ATOM     13  C   LIG    1        2.644   0.529  -0.158  0.00  0.00    -0.012 A 
ATOM     14  C   LIG    1        3.719   0.871   0.686  0.00  0.00    +0.031 A 
ATOM     15  C   LIG    1        5.016   0.937   0.152  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1        5.239   0.761  -1.213  0.00  0.00    +0.040 A 
ATOM     17  C   LIG    1        4.165   0.497  -2.047  0.00  0.00    +0.124 A 
ATOM     18  F   LIG    1        4.371   0.342  -3.361  0.00  0.00    -0.205 F 
ATOM     19  N   LIG    1        3.554   1.020   2.071  0.00  0.00    -0.344 N 
ATOM     20  H   LIG    1        4.262   1.624   2.481  0.00  0.00    +0.146 HD
ATOM     21  C   LIG    1        2.204   1.326   2.515  0.00  0.00    +0.102 C 
ATOM     22  C   LIG    1        2.877   0.383  -1.538  0.00  0.00    +0.044 A 
ATOM     23  C   LIG    1        1.237   0.312   1.934  0.00  0.00    +0.036 C 
ENDBRANCH   3  12
BRANCH   1  24
ATOM     24  N   LIG    1       -1.567  -2.866  -0.957  0.00  0.00    -0.343 N 
ATOM     25  H   LIG    1       -0.584  -3.118  -1.109  0.00  0.00    +0.144 HD
ATOM     26  H   LIG    1       -2.220  -3.442  -1.481  0.00  0.00    +0.144 HD
ENDBRANCH   1  24
TORSDOF 2