REMARK  Name = BDB063052
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.022   2.119  -1.589  0.00  0.00    +0.038 A 
ATOM      2  C   LIG    1        0.567   1.020  -0.955  0.00  0.00    +0.027 A 
ATOM      3  C   LIG    1        1.918   0.691  -1.188  0.00  0.00    +0.056 A 
ATOM      4  C   LIG    1        2.671   1.475  -2.076  0.00  0.00    +0.053 A 
ATOM      5 CL   LIG    1        4.314   1.138  -2.491  0.00  0.00    -0.083 Cl
ATOM      6  C   LIG    1        2.084   2.585  -2.695  0.00  0.00    +0.021 A 
ATOM      7  C   LIG    1        0.748   2.910  -2.449  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  10
ATOM      8  N   LIG    1       -2.297   1.496  -0.975  0.00  0.00    -0.307 N 
ATOM      9  H   LIG    1       -2.016   0.527  -1.056  0.00  0.00    +0.149 HD
ATOM     10  C   LIG    1       -1.442   2.502  -1.357  0.00  0.00    +0.244 C 
ATOM     11  O   LIG    1       -1.798   3.662  -1.532  0.00  0.00    -0.270 OA
BRANCH   8  12
ATOM     12  C   LIG    1       -3.709   1.756  -0.809  0.00  0.00    +0.140 C 
BRANCH  12  15
ATOM     13  C   LIG    1       -3.664   1.167   2.136  0.00  0.00    +0.044 C 
ATOM     14  C   LIG    1       -4.375   0.269   1.160  0.00  0.00    -0.046 A 
ATOM     15  C   LIG    1       -4.409   0.555  -0.222  0.00  0.00    -0.027 A 
ATOM     16  C   LIG    1       -5.077  -0.329  -1.088  0.00  0.00    +0.005 A 
ATOM     17  C   LIG    1       -5.715  -1.467  -0.597  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1       -5.689  -1.742   0.766  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -5.024  -0.881   1.638  0.00  0.00    +0.003 A 
ENDBRANCH  12  15
ENDBRANCH   8  12
ENDBRANCH   1  10
BRANCH   3  20
ATOM     20  C   LIG    1        2.428  -0.508  -0.461  0.00  0.00    +0.250 C 
ATOM     21  N   LIG    1        3.731  -0.441  -0.014  0.00  0.00    -0.281 N 
ATOM     22  H   LIG    1        4.262   0.385  -0.266  0.00  0.00    +0.155 HD
ATOM     23  O   LIG    1        1.638  -1.429  -0.280  0.00  0.00    -0.270 OA
BRANCH  21  24
ATOM     24  C   LIG    1        4.442  -1.412   0.723  0.00  0.00    +0.034 A 
ATOM     25  C   LIG    1        3.895  -2.621   1.157  0.00  0.00    +0.023 A 
ATOM     26  C   LIG    1        4.670  -3.529   1.886  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        5.998  -3.236   2.186  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        6.554  -2.034   1.758  0.00  0.00    +0.002 A 
ATOM     29  C   LIG    1        5.779  -1.127   1.030  0.00  0.00    +0.023 A 
ENDBRANCH  21  24
ENDBRANCH   3  20
TORSDOF 5