REMARK  Name = BDB014256
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.946   0.517  -0.406  0.00  0.00    +0.086 A 
ATOM      2  C   LIG    1       -1.890  -0.392  -0.310  0.00  0.00    +0.079 A 
ATOM      3  C   LIG    1       -2.118  -1.710   0.067  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1       -0.870  -2.375   0.081  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        0.103  -1.461  -0.286  0.00  0.00    +0.023 A 
ATOM      6  N   LIG    1       -3.348  -2.198   0.354  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -4.354  -1.305   0.256  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1       -0.537  -0.266  -0.522  0.00  0.00    -0.356 N 
ATOM      9  H   LIG    1       -0.094   0.605  -0.791  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1       -4.218   0.025  -0.108  0.00  0.00    +0.037 A 
ENDROOT
BRANCH   1  12
ATOM     11  O   LIG    1       -3.680   2.747  -0.880  0.00  0.00    -0.245 OA
ATOM     12  C   LIG    1       -2.783   1.929  -0.795  0.00  0.00    +0.339 C 
BRANCH  12  13
ATOM     13  O   LIG    1       -1.506   2.265  -1.064  0.00  0.00    -0.477 OA
ATOM     14  H   LIG    1       -1.572   3.218  -1.291  0.00  0.00    +0.295 HD
ENDBRANCH  12  13
ENDBRANCH   1  12
BRANCH   5  15
ATOM     15  C   LIG    1        1.582  -1.635  -0.440  0.00  0.00    +0.089 C 
BRANCH  15  16
ATOM     16  C   LIG    1        2.394  -0.466   0.077  0.00  0.00    -0.023 A 
ATOM     17  C   LIG    1        2.644  -0.262   1.444  0.00  0.00    +0.045 A 
ATOM     18 CL   LIG    1        2.068  -1.354   2.653  0.00  0.00    -0.083 Cl
ATOM     19  C   LIG    1        3.379   0.847   1.873  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1        3.873   1.765   0.948  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        3.634   1.577  -0.410  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        2.899   0.472  -0.844  0.00  0.00    +0.005 A 
ENDBRANCH  15  16
ENDBRANCH   5  15
TORSDOF 4