REMARK  Name = BDB036783
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.695  -0.379   0.341  0.00  0.00    -0.300 N 
ATOM      2  H   LIG    1       -1.109  -0.714  -0.420  0.00  0.00    +0.150 HD
ATOM      3  C   LIG    1       -1.197  -0.422   1.625  0.00  0.00    +0.245 C 
ATOM      4  O   LIG    1       -1.916  -0.377   2.617  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1       -6.446   0.833  -2.035  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1       -5.499   0.431  -1.365  0.00  0.00    +0.219 C 
ATOM      7  N   LIG    1       -4.611  -0.481  -1.877  0.00  0.00    -0.255 N 
ATOM      8  H   LIG    1       -4.752  -0.712  -2.851  0.00  0.00    +0.158 HD
ATOM      9  C   LIG    1       -3.363  -0.760  -1.378  0.00  0.00    +0.240 C 
ATOM     10  O   LIG    1       -2.499  -1.286  -2.080  0.00  0.00    -0.273 OA
ATOM     11  C   LIG    1       -3.129  -0.395   0.091  0.00  0.00    +0.160 C 
ATOM     12  C   LIG    1       -3.780   0.955   0.377  0.00  0.00    +0.041 C 
ATOM     13  C   LIG    1       -5.265   0.878   0.059  0.00  0.00    +0.098 C 
ENDBRANCH   1  11
BRANCH   3  14
ATOM     14  C   LIG    1        0.278  -0.571   1.764  0.00  0.00    +0.037 A 
ATOM     15  C   LIG    1        1.167  -0.159   0.760  0.00  0.00    +0.021 A 
ATOM     16  C   LIG    1        2.556  -0.308   0.917  0.00  0.00    -0.017 A 
ATOM     17  C   LIG    1        3.033  -0.874   2.112  0.00  0.00    +0.008 A 
ATOM     18  C   LIG    1        2.155  -1.272   3.122  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        0.780  -1.117   2.950  0.00  0.00    +0.013 A 
BRANCH  16  20
ATOM     20  C   LIG    1        3.486   0.124  -0.139  0.00  0.00    -0.018 A 
ATOM     21  C   LIG    1        4.525   1.028   0.138  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        5.406   1.441  -0.865  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        5.263   0.956  -2.163  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        4.240   0.059  -2.458  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        3.359  -0.353  -1.454  0.00  0.00    +0.008 A 
ENDBRANCH  16  20
ENDBRANCH   3  14
TORSDOF 3