REMARK  Name = BDB050494
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.196   1.593  -0.713  0.00  0.00    +0.004 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.048   0.588  -0.570  0.00  0.00    +0.027 C 
BRANCH   2   4
ATOM      3  C   LIG    1       -1.786   1.214   1.086  0.00  0.00    -0.031 C 
ATOM      4  C   LIG    1       -0.617   0.631   0.777  0.00  0.00    -0.031 C 
BRANCH   3   5
ATOM      5  C   LIG    1       -2.678   2.009   0.174  0.00  0.00    +0.027 C 
BRANCH   5   6
ATOM      6  C   LIG    1       -4.024   1.326  -0.086  0.00  0.00    +0.004 C 
BRANCH   6   7
ATOM      7  C   LIG    1       -3.893   0.053  -0.932  0.00  0.00    +0.000 C 
BRANCH   7   8
ATOM      8  C   LIG    1       -5.245  -0.603  -1.237  0.00  0.00    -0.000 C 
BRANCH   8  10
ATOM      9  C   LIG    1       -5.824  -1.333   1.153  0.00  0.00    +0.004 C 
ATOM     10  C   LIG    1       -5.626  -1.748  -0.295  0.00  0.00    -0.003 C 
ENDBRANCH   8  10
ENDBRANCH   7   8
ENDBRANCH   6   7
ENDBRANCH   5   6
ENDBRANCH   3   5
ENDBRANCH   2   4
ENDBRANCH   1   2
BRANCH   1  11
ATOM     11  C   LIG    1        2.352   1.431   0.282  0.00  0.00    +0.000 C 
BRANCH  11  12
ATOM     12  C   LIG    1        3.060   0.078   0.178  0.00  0.00    +0.000 C 
BRANCH  12  13
ATOM     13  C   LIG    1        4.281   0.023   1.100  0.00  0.00    +0.001 C 
BRANCH  13  14
ATOM     14  C   LIG    1        4.958  -1.352   1.137  0.00  0.00    +0.011 C 
BRANCH  14  15
ATOM     15  C   LIG    1        5.518  -1.831  -0.199  0.00  0.00    +0.120 C 
BRANCH  15  16
ATOM     16  C   LIG    1        6.581  -0.918  -0.740  0.00  0.00    +0.305 C 
ATOM     17  O   LIG    1        6.487  -0.209  -1.728  0.00  0.00    -0.251 OA
BRANCH  16  18
ATOM     18  O   LIG    1        7.715  -0.945  -0.016  0.00  0.00    -0.481 OA
ATOM     19  H   LIG    1        8.307  -0.315  -0.478  0.00  0.00    +0.295 HD
ENDBRANCH  16  18
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   1  11
TORSDOF 14