REMARK  Name = BDB060289
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.755  -2.130   0.618  0.00  0.00    +0.281 C 
ATOM      2  N   LIG    1       -0.623  -1.849   0.577  0.00  0.00    -0.163 N 
ATOM      3  C   LIG    1       -1.691  -2.726   0.736  0.00  0.00    +0.219 A 
ATOM      4  N   LIG    1       -2.816  -2.058   0.711  0.00  0.00    -0.192 NA
ATOM      5  C   LIG    1       -2.425  -0.750   0.510  0.00  0.00    +0.202 A 
ATOM      6  N   LIG    1       -1.094  -0.588   0.430  0.00  0.00    -0.139 NA
ATOM      7  O   LIG    1        1.080  -3.281   0.924  0.00  0.00    -0.265 OA
ENDROOT
BRANCH   1  13
ATOM      8  C   LIG    1        5.169   1.537  -0.334  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1        4.003   0.613  -0.113  0.00  0.00    -0.047 A 
ATOM     10  C   LIG    1        2.760   0.836  -0.739  0.00  0.00    -0.047 A 
ATOM     11  C   LIG    1        2.545   2.009  -1.657  0.00  0.00    +0.044 C 
ATOM     12  C   LIG    1        1.696  -0.054  -0.504  0.00  0.00    +0.017 A 
ATOM     13  C   LIG    1        1.849  -1.150   0.353  0.00  0.00    +0.042 A 
ATOM     14  C   LIG    1        3.092  -1.372   0.957  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1        4.156  -0.497   0.729  0.00  0.00    +0.004 A 
ENDBRANCH   1  13
BRANCH   5  16
ATOM     16  C   LIG    1       -3.402   0.344   0.396  0.00  0.00    +0.110 A 
ATOM     17  N   LIG    1       -2.920   1.596   0.166  0.00  0.00    -0.252 NA
ATOM     18  C   LIG    1       -3.818   2.598   0.063  0.00  0.00    +0.111 A 
ATOM     19  C   LIG    1       -5.187   2.422   0.174  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1       -5.668   1.139   0.407  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1       -4.766   0.084   0.520  0.00  0.00    +0.031 A 
ENDBRANCH   5  16
BRANCH   3  22
ATOM     22  N   LIG    1       -1.563  -4.059   0.885  0.00  0.00    -0.327 N 
ATOM     23  H   LIG    1       -0.646  -4.436   1.139  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1       -2.346  -4.565   1.284  0.00  0.00    +0.145 HD
ENDBRANCH   3  22
TORSDOF 3