REMARK  Name = BDB057427
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.421  -0.422   1.059  0.00  0.00    +0.172 A 
ATOM      2  C   LIG    1        0.141   0.704   0.499  0.00  0.00    +0.088 A 
ATOM      3  C   LIG    1       -0.425   2.054   0.245  0.00  0.00    +0.070 C 
ATOM      4  N   LIG    1        1.452   0.350   0.188  0.00  0.00    -0.197 N 
ATOM      5  C   LIG    1        2.467   1.127  -0.429  0.00  0.00    +0.279 C 
ATOM      6  O   LIG    1        2.207   2.302  -0.694  0.00  0.00    -0.265 OA
ATOM      7  N   LIG    1        1.736  -0.923   0.597  0.00  0.00    -0.165 NA
ATOM      8  C   LIG    1        0.603  -1.379   1.138  0.00  0.00    +0.103 A 
ATOM      9  C   LIG    1        0.528  -2.743   1.711  0.00  0.00    +0.071 C 
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1        3.835   0.641  -0.772  0.00  0.00    +0.041 A 
ATOM     11  C   LIG    1        4.897   1.558  -0.707  0.00  0.00    +0.015 A 
ATOM     12  C   LIG    1        6.195   1.162  -1.042  0.00  0.00    +0.021 A 
ATOM     13  C   LIG    1        6.434  -0.147  -1.453  0.00  0.00    +0.041 A 
ATOM     14 CL   LIG    1        8.030  -0.636  -1.866  0.00  0.00    -0.084 Cl
ATOM     15  C   LIG    1        5.385  -1.061  -1.540  0.00  0.00    +0.021 A 
ATOM     16  C   LIG    1        4.085  -0.666  -1.206  0.00  0.00    +0.015 A 
ENDBRANCH   5  10
BRANCH   1  17
ATOM     17  O   LIG    1       -1.678  -0.557   1.533  0.00  0.00    -0.452 OA
BRANCH  17  22
ATOM     18  C   LIG    1       -6.365   0.277  -1.560  0.00  0.00    +0.044 C 
ATOM     19  C   LIG    1       -5.107   0.078  -0.767  0.00  0.00    -0.050 A 
ATOM     20  C   LIG    1       -5.101   0.294   0.617  0.00  0.00    +0.007 A 
ATOM     21  C   LIG    1       -3.938   0.080   1.359  0.00  0.00    +0.046 A 
ATOM     22  C   LIG    1       -2.772  -0.350   0.726  0.00  0.00    +0.129 A 
ATOM     23  C   LIG    1       -2.778  -0.600  -0.648  0.00  0.00    +0.046 A 
ATOM     24  C   LIG    1       -3.942  -0.385  -1.390  0.00  0.00    +0.007 A 
ENDBRANCH  17  22
ENDBRANCH   1  17
TORSDOF 3