REMARK  Name = BDB058091
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.303   0.237   0.739  0.00  0.00    +0.135 C 
ATOM      2  C   LIG    1        1.041  -0.518   0.575  0.00  0.00    +0.060 C 
ATOM      3  C   LIG    1        2.157   0.262  -0.157  0.00  0.00    +0.032 C 
ATOM      4  C   LIG    1        3.470  -0.532   0.005  0.00  0.00    +0.019 C 
ATOM      5  C   LIG    1        1.894   0.447  -1.657  0.00  0.00    +0.019 C 
ATOM      6  C   LIG    1        2.325   1.647   0.483  0.00  0.00    +0.179 C 
ATOM      7  O   LIG    1        3.414   2.220   0.495  0.00  0.00    -0.291 OA
ATOM      8  C   LIG    1        1.124   2.323   1.054  0.00  0.00    +0.094 C 
ATOM      9  C   LIG    1       -0.048   1.672   1.147  0.00  0.00    +0.036 C 
ENDROOT
BRANCH   1  10
ATOM     10  C   LIG    1       -1.152   0.169  -0.554  0.00  0.00    +0.119 A 
ATOM     11  C   LIG    1       -1.706  -1.040  -1.008  0.00  0.00    +0.154 A 
ATOM     12  C   LIG    1       -2.436  -1.064  -2.197  0.00  0.00    +0.087 A 
ATOM     13  C   LIG    1       -2.634   0.121  -2.883  0.00  0.00    +0.145 A 
ATOM     14  F   LIG    1       -3.338   0.135  -4.021  0.00  0.00    -0.204 F 
ATOM     15  C   LIG    1       -2.092   1.286  -2.376  0.00  0.00    +0.149 A 
ATOM     16  N   LIG    1       -1.359   1.336  -1.236  0.00  0.00    -0.250 NA
BRANCH  11  17
ATOM     17  O   LIG    1       -1.480  -2.212  -0.341  0.00  0.00    -0.432 OA
BRANCH  17  18
ATOM     18  C   LIG    1       -2.648  -2.616   0.370  0.00  0.00    +0.541 C 
ATOM     19  F   LIG    1       -3.452  -3.299  -0.483  0.00  0.00    -0.166 F 
ATOM     20  F   LIG    1       -2.251  -3.500   1.321  0.00  0.00    -0.166 F 
ENDBRANCH  17  18
ENDBRANCH  11  17
ENDBRANCH   1  10
BRANCH   1  22
ATOM     21  C   LIG    1       -0.582  -0.649   3.014  0.00  0.00    +0.195 C 
ATOM     22  O   LIG    1       -1.160  -0.333   1.756  0.00  0.00    -0.366 OA
ENDBRANCH   1  22
BRANCH   8  23
ATOM     23  C   LIG    1        1.237   3.675   1.484  0.00  0.00    +0.102 C 
ATOM     24  N   LIG    1        1.270   4.773   1.859  0.00  0.00    -0.191 NA
ENDBRANCH   8  23
TORSDOF 5