REMARK  Name = BDB002672
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.409  -1.482   0.152  0.00  0.00    +0.366 C 
ATOM      2  O   LIG    1        0.817  -2.628   0.274  0.00  0.00    -0.243 OA
ENDROOT
BRANCH   1   7
ATOM      3  C   LIG    1       -2.905   0.387   0.134  0.00  0.00    +0.166 A 
ATOM      4  C   LIG    1       -3.688  -0.522   0.868  0.00  0.00    +0.204 A 
ATOM      5  C   LIG    1       -3.145  -1.713   1.381  0.00  0.00    +0.166 A 
ATOM      6  C   LIG    1       -1.805  -2.003   1.125  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1       -1.012  -1.109   0.389  0.00  0.00    +0.068 A 
ATOM      8  C   LIG    1       -1.565   0.081  -0.112  0.00  0.00    +0.064 A 
BRANCH   3  10
ATOM      9  C   LIG    1       -2.761   2.512  -0.952  0.00  0.00    +0.277 C 
ATOM     10  O   LIG    1       -3.543   1.518  -0.305  0.00  0.00    -0.491 OA
ENDBRANCH   3  10
BRANCH   4  11
ATOM     11  O   LIG    1       -4.997  -0.199   1.153  0.00  0.00    -0.488 OA
ATOM     12  C   LIG    1       -5.859  -0.735   0.151  0.00  0.00    +0.277 C 
ENDBRANCH   4  11
BRANCH   5  13
ATOM     13  O   LIG    1       -3.997  -2.511   2.097  0.00  0.00    -0.491 OA
ATOM     14  C   LIG    1       -3.455  -3.681   2.697  0.00  0.00    +0.277 C 
ENDBRANCH   5  13
ENDBRANCH   1   7
BRANCH   1  15
ATOM     15  O   LIG    1        1.126  -0.363  -0.165  0.00  0.00    -0.311 OA
BRANCH  15  16
ATOM     16  N   LIG    1        2.466  -0.704  -0.416  0.00  0.00    -0.074 NA
ATOM     17  C   LIG    1        3.229   0.332  -0.595  0.00  0.00    +0.107 C 
ATOM     18  C   LIG    1        4.681   0.114  -0.883  0.00  0.00    -0.018 C 
ATOM     19  C   LIG    1        5.165  -1.305  -0.933  0.00  0.00    +0.046 C 
ATOM     20  C   LIG    1        5.499   1.154  -1.087  0.00  0.00    +0.056 C 
ATOM     21  C   LIG    1        5.036   2.552  -1.040  0.00  0.00    +0.182 C 
ATOM     22  O   LIG    1        5.819   3.471  -1.243  0.00  0.00    -0.288 OA
ATOM     23  C   LIG    1        3.604   2.788  -0.739  0.00  0.00    -0.002 C 
ATOM     24  C   LIG    1        3.163   4.217  -0.679  0.00  0.00    +0.048 C 
ATOM     25  C   LIG    1        2.779   1.752  -0.535  0.00  0.00    +0.038 C 
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 6