REMARK  Name = BDB018635
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.091   0.043   0.254  0.00  0.00    -0.222 N 
ATOM      2  C   LIG    1        1.208   0.820   0.093  0.00  0.00    +0.257 C 
ATOM      3  O   LIG    1        1.323   1.862  -0.520  0.00  0.00    -0.269 OA
ATOM      4  C   LIG    1        2.300   0.136   0.773  0.00  0.00    +0.080 A 
ATOM      5  C   LIG    1        1.806  -1.066   1.244  0.00  0.00    +0.052 A 
ATOM      6  C   LIG    1        2.601  -1.989   1.903  0.00  0.00    +0.014 A 
ATOM      7  C   LIG    1        3.951  -1.668   2.090  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1        4.469  -0.445   1.624  0.00  0.00    +0.033 A 
ATOM      9  C   LIG    1        3.623   0.458   0.964  0.00  0.00    +0.139 A 
ATOM     10  C   LIG    1        0.389  -1.131   0.889  0.00  0.00    +0.255 C 
ATOM     11  O   LIG    1       -0.326  -2.086   1.121  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  18
ATOM     12  O   LIG    1       -4.394  -0.275  -3.270  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -3.527   0.030  -2.452  0.00  0.00    +0.219 C 
ATOM     14  N   LIG    1       -2.317  -0.626  -2.469  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -2.224  -1.251  -3.261  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -1.144  -0.486  -1.753  0.00  0.00    +0.240 C 
ATOM     17  O   LIG    1       -0.112  -0.982  -2.214  0.00  0.00    -0.273 OA
ATOM     18  C   LIG    1       -1.166   0.321  -0.442  0.00  0.00    +0.171 C 
ATOM     19  C   LIG    1       -2.396  -0.022   0.401  0.00  0.00    +0.033 C 
ATOM     20  C   LIG    1       -3.653   0.744  -0.011  0.00  0.00    +0.011 C 
ATOM     21  C   LIG    1       -3.730   1.157  -1.473  0.00  0.00    +0.096 C 
ENDBRANCH   1  18
BRANCH   9  22
ATOM     22  N   LIG    1        4.138   1.729   0.529  0.00  0.00    +0.057 N 
ATOM     23  O   LIG    1        3.754   2.727   1.151  0.00  0.00    -0.126 OA
ATOM     24  O   LIG    1        4.977   1.708  -0.380  0.00  0.00    -0.126 OA
ENDBRANCH   9  22
TORSDOF 2