REMARK  Name = BDB062376
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.640  -0.777   0.662  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1        1.180  -1.937   1.301  0.00  0.00    +0.162 A 
ATOM      3  C   LIG    1       -0.069  -1.899   1.926  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1       -0.831  -0.724   1.924  0.00  0.00    +0.009 A 
ATOM      5  C   LIG    1       -0.366   0.440   1.294  0.00  0.00    -0.026 A 
ATOM      6  C   LIG    1        0.891   0.403   0.680  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   2   7
ATOM      7  O   LIG    1        2.013  -3.024   1.280  0.00  0.00    -0.491 OA
ATOM      8  C   LIG    1        1.557  -4.212   1.911  0.00  0.00    +0.277 C 
ENDBRANCH   2   7
BRANCH   1   9
ATOM      9  O   LIG    1        2.869  -0.709   0.052  0.00  0.00    -0.488 OA
BRANCH   9  10
ATOM     10  C   LIG    1        2.866  -1.424  -1.189  0.00  0.00    +0.231 C 
BRANCH  10  11
ATOM     11  C   LIG    1        4.101  -1.026  -1.987  0.00  0.00    +0.069 C 
BRANCH  11  12
ATOM     12  C   LIG    1        5.393  -1.348  -1.247  0.00  0.00    +0.163 C 
BRANCH  12  14
ATOM     13  C   LIG    1        7.738  -1.281  -1.477  0.00  0.00    +0.193 C 
ATOM     14  O   LIG    1        6.489  -1.028  -2.107  0.00  0.00    -0.383 OA
ENDBRANCH  12  14
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   5  15
ATOM     15  C   LIG    1       -1.185   1.711   1.323  0.00  0.00    +0.143 C 
BRANCH  15  16
ATOM     16  N   LIG    1       -1.545   2.216  -0.009  0.00  0.00    -0.292 N 
ATOM     17  C   LIG    1       -2.570   1.688  -0.802  0.00  0.00    +0.246 C 
ATOM     18  O   LIG    1       -2.719   2.045  -1.977  0.00  0.00    -0.273 OA
BRANCH  17  19
ATOM     19  C   LIG    1       -3.516   0.638  -0.179  0.00  0.00    +0.217 C 
ATOM     20  O   LIG    1       -4.205   1.196   0.954  0.00  0.00    -0.365 OA
ATOM     21  C   LIG    1       -5.581   0.813   1.040  0.00  0.00    +0.176 C 
ATOM     22  C   LIG    1       -5.803  -0.651   0.636  0.00  0.00    +0.109 C 
ATOM     23  N   LIG    1       -5.396  -0.946  -0.745  0.00  0.00    -0.311 NA
ATOM     24  H   LIG    1       -6.215  -0.985  -1.353  0.00  0.00    +0.122 HD
ATOM     25  C   LIG    1       -4.481   0.095  -1.260  0.00  0.00    +0.122 C 
ENDBRANCH  17  19
BRANCH  16  26
ATOM     26  C   LIG    1       -0.670   3.210  -0.599  0.00  0.00    +0.077 C 
ATOM     27  C   LIG    1       -1.209   4.558  -1.014  0.00  0.00    +0.024 C 
ATOM     28  C   LIG    1       -0.245   4.463   0.125  0.00  0.00    +0.024 C 
ENDBRANCH  16  26
ENDBRANCH  15  16
ENDBRANCH   5  15
TORSDOF 10