REMARK  Name = BDB030910
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.471   0.316  -2.879  0.00  0.00    +0.096 A 
ATOM      2  C   LIG    1       -0.150   1.235  -3.703  0.00  0.00    +0.085 A 
ATOM      3 CL   LIG    1        0.646   2.294  -4.796  0.00  0.00    -0.080 Cl
ATOM      4  C   LIG    1       -1.517   1.289  -3.572  0.00  0.00    +0.136 A 
ATOM      5  N   LIG    1       -2.226   0.521  -2.717  0.00  0.00    -0.221 NA
ATOM      6  C   LIG    1       -1.536  -0.343  -1.962  0.00  0.00    +0.216 A 
ATOM      7  N   LIG    1       -0.206  -0.465  -2.002  0.00  0.00    -0.213 NA
ENDROOT
BRANCH   1  13
ATOM      8  C   LIG    1        5.051   0.134  -0.012  0.00  0.00    +0.052 A 
ATOM      9  C   LIG    1        5.213  -0.162  -1.382  0.00  0.00    +0.063 A 
ATOM     10 BR   LIG    1        6.913  -0.590  -2.119  0.00  0.00    -0.046 Br
ATOM     11  C   LIG    1        4.085  -0.139  -2.218  0.00  0.00    +0.063 A 
ATOM     12  C   LIG    1        2.809   0.167  -1.743  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1        1.912   0.109  -2.856  0.00  0.00    +0.027 A 
ATOM     14  C   LIG    1        2.655  -0.263  -3.959  0.00  0.00    +0.093 A 
ATOM     15  C   LIG    1        2.660   0.458  -0.373  0.00  0.00    +0.012 A 
ATOM     16  N   LIG    1        3.960  -0.392  -3.567  0.00  0.00    -0.359 N 
ATOM     17  H   LIG    1        4.730  -0.653  -4.169  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1        3.778   0.439   0.474  0.00  0.00    +0.025 A 
BRANCH   8  20
ATOM     19  C   LIG    1        6.294   0.356   2.154  0.00  0.00    +0.404 C 
ATOM     20  N   LIG    1        6.192   0.108   0.817  0.00  0.00    -0.250 N 
ATOM     21  H   LIG    1        7.072  -0.126   0.377  0.00  0.00    +0.158 HD
ATOM     22  O   LIG    1        5.407   0.660   2.936  0.00  0.00    -0.226 OA
BRANCH  19  24
ATOM     23  C   LIG    1        7.859   0.438   3.894  0.00  0.00    +0.282 C 
ATOM     24  O   LIG    1        7.600   0.207   2.508  0.00  0.00    -0.453 OA
ENDBRANCH  19  24
ENDBRANCH   8  20
ENDBRANCH   1  13
BRANCH   6  25
ATOM     25  N   LIG    1       -2.183  -1.170  -1.065  0.00  0.00    -0.309 N 
ATOM     26  H   LIG    1       -1.476  -1.537  -0.436  0.00  0.00    +0.149 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -3.392  -0.651  -0.432  0.00  0.00    +0.087 C 
ATOM     28  C   LIG    1       -3.076   0.487   0.566  0.00  0.00    +0.103 C 
ATOM     29  N   LIG    1       -4.250   1.017   1.269  0.00  0.00    -0.309 NA
ATOM     30  H   LIG    1       -4.724   1.695   0.671  0.00  0.00    +0.123 HD
ATOM     31  C   LIG    1       -5.205  -0.006   1.732  0.00  0.00    +0.014 C 
ATOM     32  C   LIG    1       -5.543   0.334   3.193  0.00  0.00    +0.027 C 
ATOM     33  C   LIG    1       -6.500   0.085   0.902  0.00  0.00    +0.027 C 
ATOM     34  C   LIG    1       -4.621  -1.434   1.671  0.00  0.00    +0.023 C 
ATOM     35  C   LIG    1       -4.105  -1.815   0.283  0.00  0.00    +0.025 C 
ENDBRANCH  25  27
ENDBRANCH   6  25
TORSDOF 5