REMARK  Name = BDB063534
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.618   1.879   0.483  0.00  0.00    +0.000 C 
ENDROOT
BRANCH   1   8
ATOM      2  C   LIG    1       -3.081  -2.510   2.154  0.00  0.00    +0.000 C 
ATOM      3  C   LIG    1       -2.849  -1.350   1.160  0.00  0.00    +0.000 C 
ATOM      4  C   LIG    1       -4.188  -0.728   0.575  0.00  0.00    +0.000 C 
ATOM      5  C   LIG    1       -4.594  -1.304  -0.799  0.00  0.00    +0.000 C 
ATOM      6  C   LIG    1       -5.397  -0.891   1.527  0.00  0.00    +0.000 C 
ATOM      7  O   LIG    1       -3.977   0.656   0.442  0.00  0.00    +0.000 OA
ATOM      8  B   LIG    1       -2.700   0.868   1.120  0.00  0.00    +0.000 B 
ATOM      9  O   LIG    1       -2.223  -0.302   1.851  0.00  0.00    +0.000 OA
ATOM     10  C   LIG    1       -1.872  -1.876   0.071  0.00  0.00    +0.000 C 
ENDBRANCH   1   8
BRANCH   1  11
ATOM     11  C   LIG    1       -2.188   2.647  -0.696  0.00  0.00    +0.000 A 
ATOM     12  C   LIG    1       -2.389   4.037  -0.601  0.00  0.00    +0.000 A 
ATOM     13  C   LIG    1       -2.921   4.753  -1.680  0.00  0.00    +0.000 A 
ATOM     14 CL   LIG    1       -3.167   6.484  -1.548  0.00  0.00    +0.000 Cl
ATOM     15  C   LIG    1       -3.259   4.088  -2.863  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1       -3.065   2.709  -2.969  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -2.533   1.991  -1.895  0.00  0.00    +0.000 A 
ENDBRANCH   1  11
BRANCH   1  18
ATOM     18  N   LIG    1       -0.393   1.167   0.100  0.00  0.00    +0.000 N 
ATOM     19  H   LIG    1       -0.261   0.882  -0.895  0.00  0.00    +0.000 HD
ATOM     20  C   LIG    1        0.596   0.767   1.064  0.00  0.00    +0.000 C 
ATOM     21  O   LIG    1        0.543   1.212   2.243  0.00  0.00    +0.000 OA
BRANCH  20  22
ATOM     22  C   LIG    1        1.673  -0.171   0.701  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        2.715  -0.580   1.507  0.00  0.00    +0.000 A 
ATOM     24  N   LIG    1        3.464  -1.452   0.807  0.00  0.00    +0.000 N 
ATOM     25  N   LIG    1        2.959  -1.613  -0.407  0.00  0.00    +0.000 NA
ATOM     26  C   LIG    1        1.857  -0.844  -0.496  0.00  0.00    +0.000 A 
BRANCH  24  27
ATOM     27  C   LIG    1        4.695  -2.088   1.264  0.00  0.00    +0.000 C 
BRANCH  27  28
ATOM     28  C   LIG    1        5.889  -1.332   0.747  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.724  -1.897  -0.233  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.826  -1.183  -0.714  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        8.103   0.096  -0.222  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1        7.277   0.664   0.752  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1        6.173  -0.046   1.236  0.00  0.00    +0.000 A 
ENDBRANCH  27  28
ENDBRANCH  24  27
ENDBRANCH  20  22
ENDBRANCH   1  18
TORSDOF 6