REMARK  Name = BDB030909
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.937  -0.167   0.328  0.00  0.00    +0.052 A 
ATOM      2  C   LIG    1       -4.135  -0.341  -1.058  0.00  0.00    +0.063 A 
ATOM      3 BR   LIG    1       -5.819  -0.862  -1.771  0.00  0.00    -0.046 Br
ATOM      4  C   LIG    1       -3.055  -0.123  -1.929  0.00  0.00    +0.063 A 
ATOM      5  C   LIG    1       -1.794   0.260  -1.473  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -0.948   0.401  -2.618  0.00  0.00    +0.027 A 
ATOM      7  C   LIG    1       -1.702   0.067  -3.725  0.00  0.00    +0.093 A 
ATOM      8  C   LIG    1       -1.608   0.428  -0.087  0.00  0.00    +0.012 A 
ATOM      9  N   LIG    1       -2.970  -0.230  -3.300  0.00  0.00    -0.359 N 
ATOM     10  H   LIG    1       -3.739  -0.506  -3.897  0.00  0.00    +0.165 HD
ATOM     11  C   LIG    1       -2.678   0.214   0.795  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   6  12
ATOM     12  C   LIG    1        0.465   0.751  -2.671  0.00  0.00    +0.096 A 
ATOM     13  C   LIG    1        0.962   1.795  -3.426  0.00  0.00    +0.085 A 
ATOM     14 CL   LIG    1        0.027   2.860  -4.396  0.00  0.00    -0.080 Cl
ATOM     15  C   LIG    1        2.322   1.975  -3.329  0.00  0.00    +0.136 A 
ATOM     16  N   LIG    1        3.133   1.213  -2.565  0.00  0.00    -0.221 NA
ATOM     17  C   LIG    1        2.558   0.223  -1.871  0.00  0.00    +0.216 A 
ATOM     18  N   LIG    1        1.248  -0.031  -1.887  0.00  0.00    -0.213 NA
BRANCH  17  19
ATOM     19  N   LIG    1        3.314  -0.608  -1.067  0.00  0.00    -0.309 N 
ATOM     20  H   LIG    1        2.665  -1.111  -0.473  0.00  0.00    +0.149 HD
BRANCH  19  21
ATOM     21  C   LIG    1        4.471  -0.016  -0.394  0.00  0.00    +0.087 C 
ATOM     22  C   LIG    1        5.370  -1.151   0.158  0.00  0.00    +0.103 C 
ATOM     23  N   LIG    1        4.745  -1.916   1.252  0.00  0.00    -0.314 NA
ATOM     24  H   LIG    1        3.907  -2.368   0.888  0.00  0.00    +0.122 HD
ATOM     25  C   LIG    1        4.386  -1.035   2.363  0.00  0.00    +0.081 C 
ATOM     26  C   LIG    1        3.453   0.096   1.934  0.00  0.00    +0.017 C 
ATOM     27  C   LIG    1        4.034   0.895   0.766  0.00  0.00    +0.025 C 
ENDBRANCH  19  21
ENDBRANCH  17  19
ENDBRANCH   6  12
BRANCH   1  29
ATOM     28  C   LIG    1       -5.092  -0.284   2.550  0.00  0.00    +0.404 C 
ATOM     29  N   LIG    1       -5.030  -0.388   1.192  0.00  0.00    -0.250 N 
ATOM     30  H   LIG    1       -5.904  -0.665   0.763  0.00  0.00    +0.158 HD
ATOM     31  O   LIG    1       -4.202   0.029   3.325  0.00  0.00    -0.226 OA
BRANCH  28  33
ATOM     32  C   LIG    1       -6.573  -0.532   4.347  0.00  0.00    +0.282 C 
ATOM     33  O   LIG    1       -6.359  -0.598   2.936  0.00  0.00    -0.453 OA
ENDBRANCH  28  33
ENDBRANCH   1  29
TORSDOF 5