REMARK  Name = BDB016556
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.602  -1.197   1.213  0.00  0.00    +0.084 C 
ATOM      2  C   LIG    1       -0.126  -0.734  -0.068  0.00  0.00    +0.107 C 
ATOM      3  N   LIG    1       -1.487  -0.241   0.219  0.00  0.00    -0.296 NA
ATOM      4  C   LIG    1       -1.448   0.863   1.192  0.00  0.00    +0.085 C 
ATOM      5  C   LIG    1       -0.820   0.409   2.513  0.00  0.00    +0.017 C 
ATOM      6  C   LIG    1        0.592  -0.133   2.311  0.00  0.00    +0.025 C 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        1.944  -1.712   0.960  0.00  0.00    -0.337 N 
ATOM      8  H   LIG    1        2.053  -2.703   1.186  0.00  0.00    +0.146 HD
BRANCH   7  15
ATOM      9  C   LIG    1        6.444   0.914  -1.256  0.00  0.00    +0.176 C 
ATOM     10  N   LIG    1        5.319   0.176  -0.712  0.00  0.00    -0.231 N 
ATOM     11  C   LIG    1        5.471  -1.157  -0.348  0.00  0.00    +0.287 A 
ATOM     12  O   LIG    1        6.523  -1.781  -0.485  0.00  0.00    -0.265 OA
ATOM     13  C   LIG    1        4.257  -1.806   0.228  0.00  0.00    +0.129 A 
ATOM     14 CL   LIG    1        4.397  -3.489   0.635  0.00  0.00    -0.076 Cl
ATOM     15  C   LIG    1        3.101  -1.150   0.430  0.00  0.00    +0.071 A 
ATOM     16  C   LIG    1        3.174   0.279   0.033  0.00  0.00    +0.157 A 
ATOM     17  N   LIG    1        4.179   0.901  -0.491  0.00  0.00    -0.175 NA
ENDBRANCH   7  15
ENDBRANCH   1   7
BRANCH   3  18
ATOM     18  C   LIG    1       -2.149   0.167  -1.036  0.00  0.00    +0.119 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.635   0.415  -0.881  0.00  0.00    -0.033 A 
ATOM     20  C   LIG    1       -4.196   1.645  -1.253  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1       -5.569   1.865  -1.123  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -6.394   0.859  -0.624  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -5.849  -0.369  -0.255  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -4.478  -0.591  -0.384  0.00  0.00    +0.005 A 
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 4