REMARK  Name = BDB063051
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.465  -2.076   0.114  0.00  0.00    +0.038 A 
ATOM      2  C   LIG    1        0.631  -1.394  -0.427  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1        1.897  -1.440   0.195  0.00  0.00    +0.056 A 
ATOM      4  C   LIG    1        2.056  -2.213   1.355  0.00  0.00    +0.053 A 
ATOM      5 CL   LIG    1        3.561  -2.411   2.183  0.00  0.00    -0.083 Cl
ATOM      6  C   LIG    1        0.962  -2.907   1.888  0.00  0.00    +0.021 A 
ATOM      7  C   LIG    1       -0.289  -2.839   1.273  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  10
ATOM      8  N   LIG    1       -2.102  -0.970  -1.324  0.00  0.00    -0.307 N 
ATOM      9  H   LIG    1       -1.496  -0.162  -1.314  0.00  0.00    +0.149 HD
ATOM     10  C   LIG    1       -1.817  -2.047  -0.514  0.00  0.00    +0.244 C 
ATOM     11  O   LIG    1       -2.617  -2.944  -0.269  0.00  0.00    -0.270 OA
BRANCH   8  12
ATOM     12  C   LIG    1       -3.426  -0.764  -1.868  0.00  0.00    +0.139 C 
BRANCH  12  16
ATOM     13  C   LIG    1       -6.170   0.413   2.189  0.00  0.00    +0.044 C 
ATOM     14  C   LIG    1       -5.512   0.825   0.906  0.00  0.00    -0.050 A 
ATOM     15  C   LIG    1       -4.822  -0.117   0.131  0.00  0.00    +0.008 A 
ATOM     16  C   LIG    1       -4.179   0.260  -1.059  0.00  0.00    -0.030 A 
ATOM     17  C   LIG    1       -4.212   1.603  -1.454  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1       -4.885   2.549  -0.680  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -5.528   2.162   0.496  0.00  0.00    +0.003 A 
ENDBRANCH  12  16
ENDBRANCH   8  12
ENDBRANCH   1  10
BRANCH   3  20
ATOM     20  C   LIG    1        2.978  -0.652  -0.476  0.00  0.00    +0.250 C 
ATOM     21  N   LIG    1        3.953  -0.121   0.343  0.00  0.00    -0.281 N 
ATOM     22  H   LIG    1        3.904  -0.355   1.327  0.00  0.00    +0.155 HD
ATOM     23  O   LIG    1        2.888  -0.493  -1.690  0.00  0.00    -0.270 OA
BRANCH  21  24
ATOM     24  C   LIG    1        5.053   0.681  -0.029  0.00  0.00    +0.034 A 
ATOM     25  C   LIG    1        5.311   1.101  -1.335  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1        6.426   1.899  -1.615  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        7.292   2.282  -0.594  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        7.044   1.868   0.711  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        5.930   1.072   0.992  0.00  0.00    +0.023 A 
ENDBRANCH  21  24
ENDBRANCH   3  20
TORSDOF 5