REMARK  Name = BDB002952
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.697   0.870  -0.492  0.00  0.00    +0.048 A 
ATOM      2  C   LIG    1       -2.819  -0.373   0.150  0.00  0.00    +0.048 A 
ATOM      3  C   LIG    1       -1.672  -1.136   0.372  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1       -0.405  -0.624   0.125  0.00  0.00    +0.092 A 
ATOM      5  C   LIG    1       -0.279   0.685  -0.389  0.00  0.00    +0.092 A 
ATOM      6  N   LIG    1        0.929   1.231  -0.620  0.00  0.00    -0.244 NA
ATOM      7  C   LIG    1        2.012   0.480  -0.348  0.00  0.00    +0.090 A 
ATOM      8  C   LIG    1        1.886  -0.831   0.159  0.00  0.00    +0.090 A 
ATOM      9  C   LIG    1        3.035  -1.568   0.421  0.00  0.00    +0.030 A 
ATOM     10  C   LIG    1        4.306  -1.038   0.194  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1        4.430   0.252  -0.304  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        3.282   0.999  -0.571  0.00  0.00    +0.030 A 
ATOM     13  N   LIG    1        0.678  -1.376   0.394  0.00  0.00    -0.244 NA
ATOM     14  C   LIG    1       -1.425   1.415  -0.674  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   1  15
ATOM     15  N   LIG    1       -3.849   1.642  -0.756  0.00  0.00    -0.356 N 
ATOM     16  H   LIG    1       -3.691   2.353  -1.464  0.00  0.00    +0.142 HD
ATOM     17  H   LIG    1       -4.622   1.032  -1.020  0.00  0.00    +0.142 HD
ENDBRANCH   1  15
BRANCH   2  18
ATOM     18  N   LIG    1       -4.099  -0.926   0.375  0.00  0.00    -0.356 N 
ATOM     19  H   LIG    1       -4.758  -0.187   0.616  0.00  0.00    +0.142 HD
ATOM     20  H   LIG    1       -4.093  -1.652   1.086  0.00  0.00    +0.142 HD
ENDBRANCH   2  18
TORSDOF 2