REMARK  Name = BDB056061
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.541   0.332   0.437  0.00  0.00    +0.133 A 
ATOM      2  N   LIG    1        0.023   1.597   0.670  0.00  0.00    -0.336 N 
ATOM      3  C   LIG    1        0.808   2.818   0.593  0.00  0.00    +0.149 C 
ATOM      4  C   LIG    1       -1.346   1.545   0.895  0.00  0.00    +0.070 A 
ATOM      5  C   LIG    1       -1.726   0.216   0.665  0.00  0.00    +0.007 A 
ATOM      6  C   LIG    1       -3.096  -0.123   0.749  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -4.046   0.844   1.080  0.00  0.00    +0.022 A 
ATOM      8  C   LIG    1       -3.655   2.149   1.347  0.00  0.00    +0.061 A 
ATOM      9 CL   LIG    1       -4.907   3.268   1.775  0.00  0.00    -0.082 Cl
ATOM     10  C   LIG    1       -2.302   2.529   1.269  0.00  0.00    +0.083 A 
ATOM     11 CL   LIG    1       -1.833   4.146   1.670  0.00  0.00    -0.080 Cl
ATOM     12  C   LIG    1       -0.538  -0.558   0.412  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  13
ATOM     13  C   LIG    1        1.962   0.069   0.264  0.00  0.00    +0.356 C 
ATOM     14  O   LIG    1        2.867   0.692   0.802  0.00  0.00    -0.243 OA
BRANCH  13  15
ATOM     15  O   LIG    1        2.137  -0.946  -0.621  0.00  0.00    -0.460 OA
BRANCH  15  17
ATOM     16  C   LIG    1        4.023  -0.445  -2.051  0.00  0.00    +0.048 C 
ATOM     17  C   LIG    1        3.493  -1.305  -0.919  0.00  0.00    +0.229 C 
ENDBRANCH  15  17
ENDBRANCH  13  15
ENDBRANCH   1  13
BRANCH  12  18
ATOM     18  C   LIG    1       -0.467  -2.060   0.187  0.00  0.00    +0.164 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -0.939  -2.396  -1.210  0.00  0.00    +0.097 C 
ATOM     20  N   LIG    1       -0.198  -3.034  -2.059  0.00  0.00    -0.310 NA
ATOM     21  H   LIG    1       -0.705  -3.161  -2.945  0.00  0.00    +0.186 HD
ENDBRANCH  18  19
BRANCH  18  22
ATOM     22  C   LIG    1       -1.285  -2.806   1.159  0.00  0.00    +0.076 C 
ATOM     23  N   LIG    1       -1.952  -3.393   1.909  0.00  0.00    -0.196 NA
ENDBRANCH  18  22
ENDBRANCH  12  18
TORSDOF 6