REMARK  Name = BDB063637
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.117   2.371   0.337  0.00  0.00    -0.451 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.515   1.513   1.190  0.00  0.00    +0.358 C 
ATOM      3  O   LIG    1        0.114   1.213   2.303  0.00  0.00    -0.243 OA
BRANCH   2   4
ATOM      4  C   LIG    1        1.698   1.000   0.564  0.00  0.00    +0.143 A 
ATOM      5  N   LIG    1        2.199   1.409  -0.641  0.00  0.00    -0.270 N 
ATOM      6  H   LIG    1        1.828   2.128  -1.253  0.00  0.00    +0.189 HD
ATOM      7  N   LIG    1        3.309   0.759  -1.022  0.00  0.00    -0.173 NA
ATOM      8  C   LIG    1        3.551  -0.082  -0.010  0.00  0.00    +0.096 A 
ATOM      9  C   LIG    1        2.578   0.030   1.005  0.00  0.00    +0.064 A 
BRANCH   8  10
ATOM     10  C   LIG    1        4.688  -0.996   0.014  0.00  0.00    +0.040 A 
ATOM     11  C   LIG    1        5.042  -1.905   0.984  0.00  0.00    +0.204 A 
ATOM     12  O   LIG    1        6.174  -2.567   0.623  0.00  0.00    -0.470 OA
ATOM     13  C   LIG    1        6.548  -2.076  -0.588  0.00  0.00    +0.195 A 
ATOM     14  C   LIG    1        5.666  -1.107  -1.007  0.00  0.00    +0.051 A 
ENDBRANCH   8  10
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -1.300   2.968   0.879  0.00  0.00    +0.328 C 
BRANCH  15  17
ATOM     16  O   LIG    1       -3.487   2.300   1.614  0.00  0.00    -0.272 OA
ATOM     17  C   LIG    1       -2.544   2.071   0.864  0.00  0.00    +0.255 C 
ATOM     18  N   LIG    1       -2.481   1.083  -0.106  0.00  0.00    -0.283 N 
ATOM     19  H   LIG    1       -1.641   1.069  -0.672  0.00  0.00    +0.155 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -3.442   0.095  -0.395  0.00  0.00    +0.034 A 
ATOM     21  C   LIG    1       -4.649  -0.046   0.294  0.00  0.00    +0.024 A 
ATOM     22  C   LIG    1       -5.552  -1.058  -0.054  0.00  0.00    +0.017 A 
ATOM     23  C   LIG    1       -5.249  -1.932  -1.094  0.00  0.00    +0.018 A 
ATOM     24 BR   LIG    1       -6.469  -3.296  -1.563  0.00  0.00    -0.050 Br
ATOM     25  C   LIG    1       -4.050  -1.806  -1.789  0.00  0.00    +0.017 A 
ATOM     26  C   LIG    1       -3.150  -0.795  -1.438  0.00  0.00    +0.024 A 
ENDBRANCH  18  20
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 6