REMARK  Name = BDB002863
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.520  -2.995   0.409  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        0.341  -1.798   0.217  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1        1.350  -0.934  -0.141  0.00  0.00    -0.304 N 
ATOM      4  H   LIG    1        1.110  -0.052  -0.574  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.024  -1.210   0.330  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1       -1.221   0.147   0.630  0.00  0.00    +0.020 A 
ATOM      7  C   LIG    1       -2.522   0.613   0.725  0.00  0.00    -0.002 A 
ATOM      8  C   LIG    1       -3.021   1.985   0.968  0.00  0.00    +0.080 C 
ATOM      9  C   LIG    1       -4.492   1.665   1.237  0.00  0.00    +0.234 C 
ATOM     10  O   LIG    1       -4.817   0.388   0.638  0.00  0.00    -0.491 OA
ATOM     11  C   LIG    1       -3.601  -0.234   0.524  0.00  0.00    +0.124 A 
ATOM     12  C   LIG    1       -3.437  -1.571   0.228  0.00  0.00    +0.046 A 
ATOM     13  C   LIG    1       -2.132  -2.064   0.141  0.00  0.00    +0.016 A 
ENDBRANCH   2   5
BRANCH   3  14
ATOM     14  C   LIG    1        2.670  -1.442  -0.434  0.00  0.00    +0.179 C 
BRANCH  14  15
ATOM     15  C   LIG    1        3.605  -0.296  -0.537  0.00  0.00    +0.122 A 
ATOM     16  O   LIG    1        3.336   0.631  -1.506  0.00  0.00    -0.466 OA
ATOM     17  C   LIG    1        4.304   1.580  -1.425  0.00  0.00    +0.195 A 
ATOM     18  C   LIG    1        5.189   1.282  -0.416  0.00  0.00    +0.041 A 
ATOM     19  C   LIG    1        4.737   0.070   0.160  0.00  0.00    +0.046 A 
ENDBRANCH  14  15
ENDBRANCH   3  14
TORSDOF 3