REMARK  Name = BDB055154
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.204   0.499  -0.407  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1        0.547  -0.588   0.391  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        1.874  -0.779   0.795  0.00  0.00    +0.009 A 
ATOM      4  C   LIG    1        2.877   0.118   0.409  0.00  0.00    -0.022 A 
ATOM      5  C   LIG    1        2.535   1.198  -0.409  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        1.209   1.384  -0.809  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1       -1.034   0.816  -0.882  0.00  0.00    -0.475 OA
BRANCH   7   9
ATOM      8  C   LIG    1       -3.346   0.853  -1.239  0.00  0.00    +0.067 C 
ATOM      9  C   LIG    1       -2.229   0.177  -0.421  0.00  0.00    +0.200 C 
ATOM     10  C   LIG    1       -2.480   0.491   1.063  0.00  0.00    +0.067 C 
BRANCH   9  11
ATOM     11  C   LIG    1       -2.345  -1.325  -0.746  0.00  0.00    +0.348 C 
ATOM     12  O   LIG    1       -1.682  -1.961  -1.551  0.00  0.00    -0.247 OA
BRANCH  11  13
ATOM     13  O   LIG    1       -3.329  -1.953  -0.065  0.00  0.00    -0.478 OA
ATOM     14  H   LIG    1       -3.295  -2.873  -0.404  0.00  0.00    +0.295 HD
ENDBRANCH  11  13
ENDBRANCH   9  11
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   4  15
ATOM     15  C   LIG    1        4.307  -0.115   0.816  0.00  0.00    +0.191 C 
BRANCH  15  16
ATOM     16  O   LIG    1        4.942  -1.017  -0.080  0.00  0.00    -0.390 OA
ATOM     17  H   LIG    1        4.324  -1.197  -0.810  0.00  0.00    +0.210 HD
ENDBRANCH  15  16
ENDBRANCH   4  15
TORSDOF 6