REMARK  Name = BDB063378
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.221   0.357  -1.519  0.00  0.00    -0.334 N 
ATOM      2  H   LIG    1        1.158   0.864  -2.404  0.00  0.00    +0.147 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        2.303   0.785  -0.742  0.00  0.00    +0.098 C 
ATOM      4  C   LIG    1        2.513   0.213   0.636  0.00  0.00    +0.210 C 
ATOM      5  O   LIG    1        1.818  -0.684   1.100  0.00  0.00    -0.285 OA
ATOM      6  C   LIG    1        3.603   0.736   1.468  0.00  0.00    +0.053 A 
ATOM      7  C   LIG    1        4.493   1.670   0.982  0.00  0.00    +0.123 A 
ATOM      8  N   LIG    1        5.521   2.175   1.719  0.00  0.00    -0.251 NA
ATOM      9  C   LIG    1        5.659   1.726   2.984  0.00  0.00    +0.111 A 
ATOM     10  C   LIG    1        4.817   0.789   3.555  0.00  0.00    +0.020 A 
ATOM     11  C   LIG    1        4.367   2.172  -0.401  0.00  0.00    +0.225 C 
ATOM     12  O   LIG    1        5.181   2.959  -0.871  0.00  0.00    -0.284 OA
ATOM     13  C   LIG    1        3.772   0.286   2.783  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        3.204   1.683  -1.186  0.00  0.00    +0.114 C 
ATOM     15 CL   LIG    1        3.037   2.368  -2.780  0.00  0.00    -0.077 Cl
ENDBRANCH   1   3
BRANCH   1  18
ATOM     16  C   LIG    1       -1.682  -0.948  -0.779  0.00  0.00    +0.041 C 
ATOM     17  C   LIG    1       -0.969   0.213  -0.026  0.00  0.00    +0.051 C 
ATOM     18  C   LIG    1        0.028  -0.219  -1.117  0.00  0.00    +0.038 C 
ATOM     19  C   LIG    1       -1.202  -0.269  -2.082  0.00  0.00    +0.051 C 
ATOM     20  C   LIG    1       -0.309  -1.685  -0.785  0.00  0.00    +0.051 C 
BRANCH  16  22
ATOM     21  C   LIG    1       -4.138  -0.812  -0.590  0.00  0.00    +0.283 C 
ATOM     22  N   LIG    1       -2.948  -1.524  -0.503  0.00  0.00    -0.305 N 
ATOM     23  H   LIG    1       -3.025  -2.486  -0.184  0.00  0.00    +0.149 HD
ATOM     24  O   LIG    1       -4.180   0.368  -0.932  0.00  0.00    -0.269 OA
BRANCH  21  26
ATOM     25  C   LIG    1       -6.664  -0.855  -0.281  0.00  0.00    +0.095 C 
ATOM     26  C   LIG    1       -5.378  -1.649  -0.224  0.00  0.00    +0.320 C 
ATOM     27  F   LIG    1       -5.494  -2.729  -1.054  0.00  0.00    -0.196 F 
ATOM     28  F   LIG    1       -5.248  -2.180   1.030  0.00  0.00    -0.196 F 
ENDBRANCH  21  26
ENDBRANCH  16  22
ENDBRANCH   1  18
TORSDOF 4