REMARK  Name = BDB060285
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.105   1.197  -1.999  0.00  0.00    +0.332 C 
ATOM      2  O   LIG    1        1.302   1.677  -3.105  0.00  0.00    -0.246 OA
ENDROOT
BRANCH   1   4
ATOM      3  C   LIG    1       -0.499   0.622  -0.179  0.00  0.00    +0.018 C 
ATOM      4  C   LIG    1       -0.241   1.120  -1.398  0.00  0.00    +0.092 C 
BRANCH   3   7
ATOM      5  C   LIG    1       -4.250   0.046   0.319  0.00  0.00    +0.162 A 
ATOM      6  C   LIG    1       -2.973   0.042  -0.277  0.00  0.00    +0.169 A 
ATOM      7  C   LIG    1       -1.853   0.570   0.395  0.00  0.00    +0.021 A 
ATOM      8  C   LIG    1       -2.019   1.037   1.705  0.00  0.00    +0.012 A 
ATOM      9  C   LIG    1       -3.274   1.016   2.314  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1       -4.386   0.529   1.623  0.00  0.00    +0.049 A 
BRANCH   5  12
ATOM     11  C   LIG    1       -6.597  -0.305   0.071  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1       -5.279  -0.445  -0.442  0.00  0.00    -0.491 OA
ENDBRANCH   5  12
BRANCH   6  13
ATOM     13  O   LIG    1       -2.822  -0.431  -1.563  0.00  0.00    -0.491 OA
ATOM     14  C   LIG    1       -2.715  -1.855  -1.554  0.00  0.00    +0.277 C 
ENDBRANCH   6  13
ENDBRANCH   3   7
ENDBRANCH   1   4
BRANCH   1  15
ATOM     15  O   LIG    1        2.053   0.678  -1.183  0.00  0.00    -0.454 OA
BRANCH  15  16
ATOM     16  C   LIG    1        3.373   0.734  -1.732  0.00  0.00    +0.306 C 
BRANCH  16  17
ATOM     17  C   LIG    1        4.324   0.168  -0.716  0.00  0.00    +0.146 A 
ATOM     18  O   LIG    1        4.444   0.925   0.442  0.00  0.00    -0.460 OA
ATOM     19  C   LIG    1        5.296   0.487   1.427  0.00  0.00    +0.244 A 
ATOM     20  C   LIG    1        6.040  -0.624   1.367  0.00  0.00    +0.199 A 
ATOM     21  C   LIG    1        5.936  -1.452   0.130  0.00  0.00    +0.226 A 
ATOM     22  O   LIG    1        6.570  -2.487  -0.041  0.00  0.00    -0.284 OA
ATOM     23  C   LIG    1        5.015  -0.964  -0.916  0.00  0.00    +0.100 A 
BRANCH  20  24
ATOM     24  O   LIG    1        6.884  -1.027   2.381  0.00  0.00    -0.501 OA
ATOM     25  H   LIG    1        6.838  -0.383   3.106  0.00  0.00    +0.292 HD
ENDBRANCH  20  24
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 8