REMARK  Name = BDB047086
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.775  -0.533  -0.043  0.00  0.00    +0.035 A 
ATOM      2  C   LIG    1       -0.201   0.666  -0.294  0.00  0.00    +0.222 A 
ATOM      3  N   LIG    1        1.209   0.777  -0.345  0.00  0.00    -0.180 N 
ATOM      4  C   LIG    1        2.024  -0.336  -0.107  0.00  0.00    +0.177 A 
ATOM      5  C   LIG    1        3.322   0.101  -0.240  0.00  0.00    +0.116 A 
ATOM      6  C   LIG    1        3.228   1.460  -0.553  0.00  0.00    +0.156 A 
ATOM      7  N   LIG    1        1.504  -1.559   0.185  0.00  0.00    -0.231 NA
ATOM      8  N   LIG    1        1.967   1.884  -0.617  0.00  0.00    -0.169 NA
ATOM      9  C   LIG    1        0.208  -1.665   0.214  0.00  0.00    +0.049 A 
ATOM     10  C   LIG    1       -0.339  -3.040   0.538  0.00  0.00    +0.066 C 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1       -3.283   0.210  -0.230  0.00  0.00    +0.009 C 
ATOM     12  C   LIG    1       -2.247  -0.880   0.017  0.00  0.00    +0.039 C 
ENDBRANCH   1  12
BRANCH   2  13
ATOM     13  O   LIG    1       -0.995   1.774  -0.564  0.00  0.00    -0.479 OA
ATOM     14  C   LIG    1       -0.702   2.917   0.239  0.00  0.00    +0.279 C 
ENDBRANCH   2  13
BRANCH   5  15
ATOM     15  C   LIG    1        4.504  -0.674  -0.090  0.00  0.00    +0.104 C 
ATOM     16  N   LIG    1        5.495  -1.269   0.025  0.00  0.00    -0.191 NA
ENDBRANCH   5  15
TORSDOF 3