REMARK  Name = BDB005640
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.436   0.634   0.581  0.00  0.00    +0.132 A 
ATOM      2  C   LIG    1       -0.409  -0.461   0.320  0.00  0.00    +0.061 A 
ATOM      3  C   LIG    1        0.207  -1.710   0.118  0.00  0.00    +0.055 A 
ATOM      4  N   LIG    1       -0.572  -2.836  -0.170  0.00  0.00    -0.322 N 
ATOM      5  H   LIG    1       -0.139  -3.737  -0.319  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -1.932  -2.817  -0.268  0.00  0.00    +0.254 A 
ATOM      7  C   LIG    1       -2.602  -1.511  -0.046  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1       -4.107  -1.495  -0.130  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1       -4.691  -0.078  -0.200  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1       -3.964   0.860   0.756  0.00  0.00    +0.102 C 
ATOM     11  N   LIG    1       -2.541   0.807   0.470  0.00  0.00    -0.343 N 
ATOM     12  H   LIG    1       -1.963   1.467   0.996  0.00  0.00    +0.146 HD
ATOM     13  O   LIG    1       -2.564  -3.839  -0.519  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1        1.597  -1.870   0.197  0.00  0.00    +0.031 A 
ATOM     15  C   LIG    1        2.418  -0.779   0.497  0.00  0.00    -0.028 A 
ATOM     16  C   LIG    1       -1.893  -0.399   0.236  0.00  0.00    +0.048 A 
ATOM     17  C   LIG    1        1.825   0.473   0.690  0.00  0.00    +0.051 A 
ENDROOT
BRANCH   1  18
ATOM     18  O   LIG    1       -0.074   1.893   0.800  0.00  0.00    -0.492 OA
BRANCH  18  20
ATOM     19  C   LIG    1       -0.626   4.017  -0.147  0.00  0.00    +0.048 C 
ATOM     20  C   LIG    1        0.109   2.708  -0.368  0.00  0.00    +0.226 C 
ENDBRANCH  18  20
ENDBRANCH   1  18
BRANCH  15  21
ATOM     21  C   LIG    1        3.916  -0.934   0.591  0.00  0.00    +0.116 C 
BRANCH  21  22
ATOM     22  N   LIG    1        4.570  -0.326  -0.566  0.00  0.00    -0.315 NA
ATOM     23  H   LIG    1        4.215  -0.764  -1.415  0.00  0.00    +0.122 HD
ATOM     24  C   LIG    1        6.014  -0.496  -0.500  0.00  0.00    +0.101 C 
ENDBRANCH  21  22
ENDBRANCH  15  21
TORSDOF 4