REMARK  Name = BDB050144
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.028   0.713   0.513  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1       -1.051   0.168  -0.351  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1       -1.393  -0.889  -1.211  0.00  0.00    +0.032 A 
ATOM      4  C   LIG    1       -2.679  -1.422  -1.193  0.00  0.00    +0.042 A 
ATOM      5 CL   LIG    1       -3.085  -2.716  -2.252  0.00  0.00    -0.084 Cl
ATOM      6  C   LIG    1       -3.635  -0.923  -0.315  0.00  0.00    +0.022 A 
ATOM      7  C   LIG    1       -3.302   0.126   0.545  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   2   8
ATOM      8  C   LIG    1        0.311   0.697  -0.397  0.00  0.00    +0.095 A 
ATOM      9  N   LIG    1        1.442  -0.010  -0.042  0.00  0.00    -0.211 N 
ATOM     10  C   LIG    1        2.519   0.852  -0.198  0.00  0.00    +0.155 A 
ATOM     11  C   LIG    1        3.801   0.354   0.124  0.00  0.00    +0.051 A 
ATOM     12  C   LIG    1        3.921  -0.908   0.553  0.00  0.00    +0.045 A 
ATOM     13  C   LIG    1        2.678  -1.718   0.661  0.00  0.00    +0.150 A 
ATOM     14 CL   LIG    1        2.798  -3.353   1.201  0.00  0.00    -0.060 Cl
ATOM     15  N   LIG    1        2.143   2.032  -0.639  0.00  0.00    -0.234 NA
ATOM     16  N   LIG    1        1.482  -1.308   0.380  0.00  0.00    -0.153 NA
ATOM     17  C   LIG    1        0.782   1.941  -0.775  0.00  0.00    +0.141 A 
ENDBRANCH   2   8
BRANCH   1  18
ATOM     18  N   LIG    1       -1.711   1.663   1.499  0.00  0.00    -0.357 N 
ATOM     19  H   LIG    1       -2.500   2.215   1.819  0.00  0.00    +0.142 HD
ATOM     20  H   LIG    1       -0.895   2.231   1.295  0.00  0.00    +0.142 HD
ENDBRANCH   1  18
TORSDOF 2