REMARK  Name = BDB061062
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.722   0.676   0.485  0.00  0.00    -0.046 A 
ATOM      2  C   LIG    1       -1.534   0.871  -0.886  0.00  0.00    +0.005 A 
ATOM      3  C   LIG    1       -0.267   0.720  -1.458  0.00  0.00    +0.023 A 
ATOM      4  C   LIG    1        0.843   0.369  -0.677  0.00  0.00    +0.031 A 
ATOM      5  C   LIG    1        0.649   0.176   0.695  0.00  0.00    +0.023 A 
ATOM      6  C   LIG    1       -0.619   0.323   1.270  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   4   7
ATOM      7  N   LIG    1        2.096   0.254  -1.321  0.00  0.00    -0.312 N 
ATOM      8  H   LIG    1        2.010  -0.328  -2.156  0.00  0.00    +0.152 HD
BRANCH   7   9
ATOM      9  C   LIG    1        3.340   0.141  -0.716  0.00  0.00    +0.075 A 
ATOM     10  C   LIG    1        4.334  -0.687  -1.067  0.00  0.00    +0.129 A 
ATOM     11 CL   LIG    1        4.125  -1.816  -2.367  0.00  0.00    -0.076 Cl
ATOM     12  C   LIG    1        5.642  -0.712  -0.352  0.00  0.00    +0.287 A 
ATOM     13  O   LIG    1        6.540  -1.478  -0.696  0.00  0.00    -0.265 OA
ATOM     14  N   LIG    1        5.757   0.172   0.717  0.00  0.00    -0.231 N 
ATOM     15  C   LIG    1        7.002   0.250   1.459  0.00  0.00    +0.176 C 
ATOM     16  N   LIG    1        4.813   1.116   1.033  0.00  0.00    -0.175 NA
ATOM     17  C   LIG    1        3.710   1.096   0.359  0.00  0.00    +0.157 A 
ENDBRANCH   7   9
ENDBRANCH   4   7
BRANCH   1  18
ATOM     18  C   LIG    1       -3.091   0.830   1.105  0.00  0.00    +0.050 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.994  -0.409   0.938  0.00  0.00    +0.088 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -5.503   0.351  -0.820  0.00  0.00    +0.104 C 
ATOM     21  N   LIG    1       -4.493  -0.637  -0.434  0.00  0.00    -0.308 NA
ATOM     22  C   LIG    1       -5.056  -1.985  -0.545  0.00  0.00    +0.104 C 
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 5