REMARK  Name = BDB021157
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.160  -0.202   0.356  0.00  0.00    +0.133 A 
ATOM      2  C   LIG    1       -1.897  -0.735   0.554  0.00  0.00    +0.091 A 
ATOM      3  C   LIG    1       -0.625  -0.511  -0.146  0.00  0.00    +0.258 C 
ATOM      4  N   LIG    1        0.301  -1.332   0.445  0.00  0.00    -0.222 N 
ATOM      5  C   LIG    1       -0.231  -2.004   1.509  0.00  0.00    +0.255 C 
ATOM      6  O   LIG    1        0.315  -2.768   2.282  0.00  0.00    -0.270 OA
ATOM      7  O   LIG    1       -0.442   0.277  -1.055  0.00  0.00    -0.269 OA
ATOM      8  C   LIG    1       -1.644  -1.644   1.569  0.00  0.00    +0.053 A 
ATOM      9  C   LIG    1       -2.623  -2.074   2.442  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -3.904  -1.553   2.263  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1       -4.170  -0.628   1.230  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4  12
ATOM     12  C   LIG    1        1.729  -1.320   0.157  0.00  0.00    +0.171 C 
ATOM     13  C   LIG    1        2.358  -0.056   0.756  0.00  0.00    +0.243 C 
ATOM     14  O   LIG    1        1.819   0.558   1.681  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1        3.608   0.308   0.235  0.00  0.00    -0.241 N 
ATOM     16  C   LIG    1        4.234  -0.278  -0.867  0.00  0.00    +0.222 C 
ATOM     17  O   LIG    1        5.303   0.122  -1.331  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        3.568  -1.499  -1.461  0.00  0.00    +0.099 C 
ATOM     19  C   LIG    1        2.062  -1.433  -1.321  0.00  0.00    +0.041 C 
BRANCH  15  20
ATOM     20  C   LIG    1        4.247   1.490   0.810  0.00  0.00    +0.113 C 
ATOM     21  C   LIG    1        3.793   2.769   0.120  0.00  0.00    +0.025 C 
ENDBRANCH  15  20
ENDBRANCH   4  12
BRANCH   1  22
ATOM     22  O   LIG    1       -3.316   0.678  -0.670  0.00  0.00    -0.491 OA
BRANCH  22  24
ATOM     23  C   LIG    1       -4.497   2.270  -1.990  0.00  0.00    +0.048 C 
ATOM     24  C   LIG    1       -4.591   1.297  -0.829  0.00  0.00    +0.226 C 
ENDBRANCH  22  24
ENDBRANCH   1  22
TORSDOF 4