REMARK  Name = BDB049220
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.573  -0.679  -0.894  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1        0.962  -1.672  -1.787  0.00  0.00    +0.104 C 
ATOM      3  C   LIG    1       -0.433  -1.887  -1.169  0.00  0.00    +0.079 C 
ATOM      4  C   LIG    1       -0.844  -0.424  -0.883  0.00  0.00    +0.053 C 
ATOM      5  C   LIG    1        0.492   0.239  -0.481  0.00  0.00    +0.094 C 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1       -1.937  -0.200   0.127  0.00  0.00    -0.016 A 
ATOM      7  C   LIG    1       -2.619   1.043   0.356  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1       -3.557   0.836   1.371  0.00  0.00    +0.049 A 
ATOM      9  C   LIG    1       -4.394   1.862   1.838  0.00  0.00    +0.026 A 
ATOM     10  C   LIG    1       -4.270   3.127   1.256  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -3.345   3.361   0.244  0.00  0.00    +0.001 A 
ATOM     12  N   LIG    1       -3.455  -0.487   1.742  0.00  0.00    -0.349 N 
ATOM     13  C   LIG    1       -4.258  -1.127   2.759  0.00  0.00    +0.149 C 
ATOM     14  C   LIG    1       -2.517   2.330  -0.214  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -2.487  -1.114   1.006  0.00  0.00    +0.090 A 
ENDBRANCH   4   6
BRANCH   3  16
ATOM     16  N   LIG    1       -1.394  -2.725  -1.922  0.00  0.00    -0.304 NA
ATOM     17  C   LIG    1       -1.779  -2.201  -3.229  0.00  0.00    +0.104 C 
ATOM     18  C   LIG    1       -0.921  -4.103  -2.044  0.00  0.00    +0.104 C 
ENDBRANCH   3  16
BRANCH   1  19
ATOM     19  C   LIG    1        2.716   0.001  -1.512  0.00  0.00    +0.122 C 
BRANCH  19  23
ATOM     20  C   LIG    1        5.057   0.686   2.918  0.00  0.00    +0.044 C 
ATOM     21  C   LIG    1        4.613   1.220   1.588  0.00  0.00    -0.050 A 
ATOM     22  C   LIG    1        3.889   0.404   0.706  0.00  0.00    +0.011 A 
ATOM     23  C   LIG    1        3.480   0.881  -0.551  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1        3.840   2.180  -0.915  0.00  0.00    +0.128 A 
ATOM     25  F   LIG    1        3.486   2.663  -2.115  0.00  0.00    -0.205 F 
ATOM     26  C   LIG    1        4.571   2.996  -0.059  0.00  0.00    +0.039 A 
ATOM     27  C   LIG    1        4.961   2.517   1.191  0.00  0.00    +0.006 A 
ENDBRANCH  19  23
ENDBRANCH   1  19
TORSDOF 4