REMARK  Name = BDB048883
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.605   0.175  -0.050  0.00  0.00    +0.141 A 
ATOM      2  N   LIG    1        2.451  -0.812  -0.511  0.00  0.00    -0.337 N 
ATOM      3  H   LIG    1        2.163  -1.679  -0.936  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1        3.745  -0.410  -0.315  0.00  0.00    +0.087 A 
ATOM      5  C   LIG    1        3.622   0.843   0.269  0.00  0.00    +0.178 A 
ATOM      6  N   LIG    1        4.681   1.602   0.628  0.00  0.00    -0.233 NA
ATOM      7  C   LIG    1        5.884   1.034   0.368  0.00  0.00    +0.133 A 
ATOM      8  C   LIG    1        6.083  -0.215  -0.215  0.00  0.00    +0.061 A 
ATOM      9 CL   LIG    1        7.674  -0.807  -0.485  0.00  0.00    -0.082 Cl
ATOM     10  C   LIG    1        4.984  -0.989  -0.582  0.00  0.00    +0.051 A 
ATOM     11  N   LIG    1        2.312   1.189   0.421  0.00  0.00    -0.208 NA
ENDROOT
BRANCH   1  15
ATOM     12  C   LIG    1       -2.737   0.052  -0.161  0.00  0.00    +0.029 A 
ATOM     13  C   LIG    1       -1.960  -1.078  -0.468  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -0.554  -1.062  -0.434  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1        0.140   0.101  -0.099  0.00  0.00    +0.017 A 
ATOM     16  C   LIG    1       -0.613   1.238   0.200  0.00  0.00    +0.013 A 
ATOM     17  C   LIG    1       -2.016   1.213   0.161  0.00  0.00    +0.024 A 
BRANCH  12  19
ATOM     18  C   LIG    1       -4.888   1.183   0.265  0.00  0.00    +0.129 C 
ATOM     19  N   LIG    1       -4.135   0.027  -0.218  0.00  0.00    -0.336 N 
ATOM     20  C   LIG    1       -4.816  -1.262  -0.094  0.00  0.00    +0.129 C 
ENDBRANCH  12  19
ENDBRANCH   1  15
TORSDOF 2