REMARK  Name = BDB063375
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.884  -1.744   1.366  0.00  0.00    -0.334 N 
ATOM      2  H   LIG    1        0.845  -1.948   2.367  0.00  0.00    +0.147 HD
ENDROOT
BRANCH   1  12
ATOM      3  O   LIG    1        5.251  -0.042   2.431  0.00  0.00    -0.286 OA
ATOM      4  C   LIG    1        4.381  -0.268   1.598  0.00  0.00    +0.208 C 
ATOM      5  C   LIG    1        4.616   0.074   0.194  0.00  0.00    +0.052 A 
ATOM      6  C   LIG    1        3.708  -0.285  -0.780  0.00  0.00    +0.123 A 
ATOM      7  N   LIG    1        3.885   0.005  -2.099  0.00  0.00    -0.251 NA
ATOM      8  C   LIG    1        5.005   0.675  -2.444  0.00  0.00    +0.111 A 
ATOM      9  C   LIG    1        5.969   1.071  -1.533  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.485  -1.046  -0.428  0.00  0.00    +0.227 C 
ATOM     11  O   LIG    1        1.802  -1.567  -1.306  0.00  0.00    -0.284 OA
ATOM     12  C   LIG    1        2.132  -1.191   1.034  0.00  0.00    +0.099 C 
ATOM     13  C   LIG    1        5.771   0.763  -0.190  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        3.066  -0.859   1.945  0.00  0.00    +0.113 C 
ATOM     15 CL   LIG    1        2.755  -1.072   3.642  0.00  0.00    -0.078 Cl
ENDBRANCH   1  12
BRANCH   1  16
ATOM     16  C   LIG    1       -0.326  -1.212   0.928  0.00  0.00    +0.038 C 
ATOM     17  C   LIG    1       -0.837  -0.798  -0.464  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1       -2.029  -0.525   0.493  0.00  0.00    +0.040 C 
ATOM     19  C   LIG    1       -0.991   0.072   1.481  0.00  0.00    +0.051 C 
ATOM     20  C   LIG    1       -1.699  -1.899   1.137  0.00  0.00    +0.051 C 
BRANCH  18  21
ATOM     21  N   LIG    1       -3.321  -0.041   0.158  0.00  0.00    -0.309 N 
ATOM     22  H   LIG    1       -4.084  -0.695   0.015  0.00  0.00    +0.149 HD
ATOM     23  C   LIG    1       -3.554   1.272  -0.178  0.00  0.00    +0.222 C 
ATOM     24  O   LIG    1       -2.706   2.154  -0.153  0.00  0.00    -0.275 OA
BRANCH  23  25
ATOM     25  C   LIG    1       -4.939   1.614  -0.555  0.00  0.00    +0.149 C 
ATOM     26  C   LIG    1       -5.818   0.692  -1.307  0.00  0.00    +0.261 C 
ATOM     27  F   LIG    1       -7.162   0.637  -1.022  0.00  0.00    -0.205 F 
ATOM     28  F   LIG    1       -5.413  -0.590  -1.600  0.00  0.00    -0.205 F 
ATOM     29  C   LIG    1       -5.253   1.852  -2.026  0.00  0.00    +0.095 C 
ENDBRANCH  23  25
ENDBRANCH  18  21
ENDBRANCH   1  16
TORSDOF 4