REMARK  Name = BDB018332
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.567  -2.697  -0.007  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -2.259  -2.062   0.022  0.00  0.00    -0.318 N 
ATOM      3  C   LIG    1       -1.125  -2.848   0.168  0.00  0.00    +0.252 A 
ATOM      4  O   LIG    1       -1.122  -4.070   0.284  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1        0.165  -2.118   0.184  0.00  0.00    +0.079 A 
ATOM      6  C   LIG    1        0.218  -0.780   0.045  0.00  0.00    -0.004 A 
ATOM      7  C   LIG    1       -1.024  -0.005  -0.120  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -2.189  -0.686  -0.119  0.00  0.00    +0.098 A 
ENDROOT
BRANCH   6   9
ATOM      9  C   LIG    1        1.573  -0.192   0.119  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1        2.481  -0.358  -0.938  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1        3.757   0.203  -0.865  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.135   0.933   0.261  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1        3.240   1.102   1.316  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        1.963   0.541   1.247  0.00  0.00    +0.008 A 
ENDBRANCH   6   9
BRANCH   7  15
ATOM     15  C   LIG    1       -1.019   1.421  -0.283  0.00  0.00    +0.021 A 
ATOM     16  C   LIG    1       -1.833   2.320   0.373  0.00  0.00    +0.113 A 
ATOM     17  N   LIG    1       -1.488   3.555  -0.095  0.00  0.00    -0.284 N 
ATOM     18  H   LIG    1       -1.871   4.457   0.169  0.00  0.00    +0.188 HD
ATOM     19  N   LIG    1       -0.519   3.524  -1.023  0.00  0.00    -0.182 NA
ATOM     20  C   LIG    1       -0.227   2.224  -1.132  0.00  0.00    +0.142 A 
ENDBRANCH   7  15
TORSDOF 2