REMARK  Name = BDB052918
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.573  -1.684   0.441  0.00  0.00    +0.042 A 
ATOM      2  C   LIG    1       -2.715  -0.942   0.049  0.00  0.00    +0.068 A 
ATOM      3  C   LIG    1       -3.919  -1.635  -0.098  0.00  0.00    +0.230 A 
ATOM      4  O   LIG    1       -4.911  -0.794  -0.494  0.00  0.00    -0.437 OA
ATOM      5  C   LIG    1       -4.369   0.445  -0.601  0.00  0.00    +0.138 A 
ATOM      6  C   LIG    1       -5.070   1.588  -0.984  0.00  0.00    +0.047 A 
ATOM      7  C   LIG    1       -4.345   2.781  -1.038  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1       -2.987   2.809  -0.720  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -2.308   1.641  -0.338  0.00  0.00    +0.012 A 
ATOM     10  N   LIG    1       -4.139  -2.946   0.104  0.00  0.00    -0.220 NA
ATOM     11  C   LIG    1       -3.041  -3.608   0.509  0.00  0.00    +0.116 A 
ATOM     12  C   LIG    1       -3.016   0.422  -0.277  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1       -1.784  -3.049   0.689  0.00  0.00    +0.043 A 
ENDROOT
BRANCH   1  14
ATOM     14  N   LIG    1       -0.311  -1.099   0.631  0.00  0.00    -0.339 N 
ATOM     15  H   LIG    1       -0.311  -0.117   0.374  0.00  0.00    +0.146 HD
BRANCH  14  16
ATOM     16  C   LIG    1        0.833  -1.795   0.047  0.00  0.00    +0.137 C 
BRANCH  16  20
ATOM     17  C   LIG    1        4.232   0.883   0.118  0.00  0.00    +0.120 A 
ATOM     18  C   LIG    1        3.582   0.595  -1.084  0.00  0.00    +0.046 A 
ATOM     19  C   LIG    1        2.487  -0.272  -1.115  0.00  0.00    +0.009 A 
ATOM     20  C   LIG    1        2.029  -0.872   0.063  0.00  0.00    -0.030 A 
ATOM     21  C   LIG    1        2.678  -0.573   1.269  0.00  0.00    +0.009 A 
ATOM     22  C   LIG    1        3.774   0.296   1.297  0.00  0.00    +0.046 A 
BRANCH  17  24
ATOM     23  C   LIG    1        5.987   2.066   1.201  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1        5.286   1.747   0.005  0.00  0.00    -0.495 OA
ENDBRANCH  17  24
ENDBRANCH  16  20
ENDBRANCH  14  16
ENDBRANCH   1  14
TORSDOF 4