REMARK  Name = BDB060557
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.253  -0.583  -0.822  0.00  0.00    +0.129 A 
ATOM      2  C   LIG    1       -1.508   0.018  -0.674  0.00  0.00    +0.054 A 
ATOM      3  C   LIG    1       -2.571  -0.637  -0.019  0.00  0.00    +0.003 A 
ATOM      4  C   LIG    1       -2.305  -1.936   0.459  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1       -1.058  -2.551   0.291  0.00  0.00    +0.049 A 
ATOM      6  C   LIG    1       -0.030  -1.876  -0.359  0.00  0.00    +0.050 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -3.947   0.044   0.152  0.00  0.00    -0.009 C 
ATOM      8  C   LIG    1       -4.014   1.470  -0.453  0.00  0.00    +0.015 C 
ATOM      9  C   LIG    1       -4.291   0.195   1.650  0.00  0.00    +0.015 C 
ATOM     10  C   LIG    1       -5.047  -0.777  -0.558  0.00  0.00    +0.015 C 
ENDBRANCH   3   7
BRANCH   4  11
ATOM     11  O   LIG    1       -3.285  -2.637   1.106  0.00  0.00    -0.506 OA
ATOM     12  H   LIG    1       -2.946  -3.511   1.355  0.00  0.00    +0.292 HD
ENDBRANCH   4  11
BRANCH   1  13
ATOM     13  O   LIG    1        0.709   0.134  -1.498  0.00  0.00    -0.455 OA
BRANCH  13  18
ATOM     14  C   LIG    1        4.516   0.468   0.204  0.00  0.00    +0.019 A 
ATOM     15  C   LIG    1        4.366   0.057  -1.125  0.00  0.00    +0.035 A 
ATOM     16  C   LIG    1        3.087  -0.060  -1.680  0.00  0.00    +0.084 A 
ATOM     17 CL   LIG    1        2.952  -0.570  -3.324  0.00  0.00    -0.080 Cl
ATOM     18  C   LIG    1        1.952   0.218  -0.911  0.00  0.00    +0.147 A 
ATOM     19  C   LIG    1        2.100   0.648   0.411  0.00  0.00    +0.048 A 
ATOM     20  C   LIG    1        3.377   0.764   0.967  0.00  0.00    +0.015 A 
BRANCH  14  22
ATOM     21  C   LIG    1        7.093   0.348   0.028  0.00  0.00    +0.091 C 
ATOM     22  C   LIG    1        5.857   0.608   0.848  0.00  0.00    +0.160 C 
ATOM     23  O   LIG    1        5.934   0.929   2.032  0.00  0.00    -0.292 OA
ENDBRANCH  14  22
ENDBRANCH  13  18
ENDBRANCH   1  13
TORSDOF 5