REMARK  Name = BDB064441
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.299   1.470   1.121  0.00  0.00    +0.086 C 
ATOM      2  C   LIG    1        4.058   0.872   0.541  0.00  0.00    +0.110 A 
ATOM      3  O   LIG    1        3.003   1.793   0.349  0.00  0.00    -0.427 OA
ATOM      4  C   LIG    1        1.796   1.399  -0.166  0.00  0.00    +0.351 A 
ATOM      5  O   LIG    1        0.878   2.202  -0.305  0.00  0.00    -0.244 OA
ATOM      6  C   LIG    1        1.646  -0.025  -0.529  0.00  0.00    +0.147 A 
ATOM      7  C   LIG    1        2.667  -0.873  -0.328  0.00  0.00    +0.138 A 
ATOM      8  C   LIG    1        3.915  -0.420   0.224  0.00  0.00    +0.087 A 
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1        0.392  -0.530  -1.140  0.00  0.00    +0.196 C 
ATOM     10  O   LIG    1        0.384  -1.145  -2.202  0.00  0.00    -0.287 OA
BRANCH   9  11
ATOM     11  C   LIG    1       -0.859  -0.238  -0.385  0.00  0.00    +0.052 C 
ATOM     12  C   LIG    1       -2.041  -0.650  -0.867  0.00  0.00    +0.012 C 
BRANCH  12  13
ATOM     13  C   LIG    1       -3.322  -0.405  -0.193  0.00  0.00    -0.022 A 
ATOM     14  C   LIG    1       -3.618   0.811   0.425  0.00  0.00    +0.027 A 
ATOM     15  C   LIG    1       -4.862   0.968   1.015  0.00  0.00    +0.111 A 
ATOM     16  N   LIG    1       -5.816   0.013   1.025  0.00  0.00    -0.263 NA
ATOM     17  C   LIG    1       -5.515  -1.147   0.405  0.00  0.00    +0.111 A 
ATOM     18  C   LIG    1       -4.301  -1.399  -0.215  0.00  0.00    +0.027 A 
ENDBRANCH  12  13
ENDBRANCH   9  11
ENDBRANCH   6   9
BRANCH   7  19
ATOM     19  O   LIG    1        2.583  -2.221  -0.597  0.00  0.00    -0.506 OA
ATOM     20  H   LIG    1        3.472  -2.609  -0.651  0.00  0.00    +0.292 HD
ENDBRANCH   7  19
TORSDOF 4