REMARK  Name = BDB056470
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.273  -1.909   1.629  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -2.631  -0.767   0.718  0.00  0.00    -0.024 A 
ATOM      3  C   LIG    1       -1.623  -0.009   0.096  0.00  0.00    +0.081 A 
ATOM      4  C   LIG    1       -2.000   1.047  -0.742  0.00  0.00    +0.065 A 
ATOM      5  C   LIG    1       -0.927   1.823  -1.384  0.00  0.00    +0.259 A 
ATOM      6  N   LIG    1        0.352   1.448  -1.065  0.00  0.00    -0.306 N 
ATOM      7  H   LIG    1        1.073   1.957  -1.553  0.00  0.00    +0.170 HD
ATOM      8  C   LIG    1        0.647   0.393  -0.232  0.00  0.00    +0.141 A 
ATOM      9  O   LIG    1       -1.155   2.742  -2.162  0.00  0.00    -0.267 OA
ATOM     10  C   LIG    1       -3.343   1.358  -0.975  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1       -4.335   0.603  -0.355  0.00  0.00    +0.001 A 
ATOM     12  N   LIG    1       -0.271  -0.326   0.330  0.00  0.00    -0.229 NA
ATOM     13  C   LIG    1       -3.981  -0.453   0.486  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   8  14
ATOM     14  C   LIG    1        2.087   0.091  -0.009  0.00  0.00    +0.017 A 
ATOM     15  C   LIG    1        2.457  -1.229   0.287  0.00  0.00    +0.013 A 
ATOM     16  C   LIG    1        3.799  -1.554   0.504  0.00  0.00    +0.021 A 
ATOM     17  C   LIG    1        4.771  -0.558   0.434  0.00  0.00    +0.041 A 
ATOM     18 CL   LIG    1        6.422  -0.955   0.703  0.00  0.00    -0.084 Cl
ATOM     19  C   LIG    1        4.412   0.760   0.155  0.00  0.00    +0.021 A 
ATOM     20  C   LIG    1        3.070   1.088  -0.064  0.00  0.00    +0.013 A 
ENDBRANCH   8  14
TORSDOF 1