REMARK  Name = BDB062188
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.595  -1.882  -0.767  0.00  0.00    +0.041 C 
ATOM      2  C   LIG    1        0.337  -1.534  -0.467  0.00  0.00    +0.130 C 
ATOM      3  C   LIG    1       -0.817  -2.424  -0.767  0.00  0.00    +0.269 C 
ATOM      4  O   LIG    1       -0.819  -3.534  -1.258  0.00  0.00    -0.268 OA
ATOM      5  N   LIG    1       -1.869  -1.682  -0.343  0.00  0.00    -0.253 N 
ATOM      6  H   LIG    1       -2.821  -2.004  -0.337  0.00  0.00    +0.158 HD
ATOM      7  C   LIG    1       -1.415  -0.507   0.159  0.00  0.00    +0.192 C 
ATOM      8  N   LIG    1       -0.120  -0.373   0.120  0.00  0.00    -0.213 NA
ENDROOT
BRANCH   1  15
ATOM      9  C   LIG    1        5.807   1.633   1.427  0.00  0.00    +0.466 C 
ATOM     10  O   LIG    1        4.476   1.222   1.802  0.00  0.00    -0.453 OA
ATOM     11  C   LIG    1        4.160   0.401   0.764  0.00  0.00    +0.167 A 
ATOM     12  C   LIG    1        5.179   0.302  -0.153  0.00  0.00    +0.166 A 
ATOM     13  C   LIG    1        5.067  -0.486  -1.276  0.00  0.00    +0.050 A 
ATOM     14  C   LIG    1        3.870  -1.189  -1.458  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1        2.808  -1.085  -0.530  0.00  0.00    -0.019 A 
ATOM     16  C   LIG    1        2.970  -0.281   0.608  0.00  0.00    +0.057 A 
ATOM     17  O   LIG    1        6.262   1.049   0.189  0.00  0.00    -0.453 OA
ENDBRANCH   1  15
BRANCH   7  18
ATOM     18  N   LIG    1       -2.245   0.423   0.702  0.00  0.00    -0.287 N 
ATOM     19  H   LIG    1       -1.752   1.202   1.126  0.00  0.00    +0.155 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -3.570   0.736   0.349  0.00  0.00    +0.033 A 
ATOM     21  C   LIG    1       -4.356   1.437   1.276  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -5.692   1.744   1.005  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -6.264   1.352  -0.201  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -5.500   0.656  -1.133  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -4.163   0.348  -0.858  0.00  0.00    +0.023 A 
ENDBRANCH  18  20
ENDBRANCH   7  18
TORSDOF 3