REMARK  Name = BDB059650
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.516  -0.587  -0.161  0.00  0.00    +0.045 A 
ATOM      2  C   LIG    1       -2.984  -0.205  -0.075  0.00  0.00    +0.279 A 
ATOM      3  O   LIG    1       -3.909  -1.003  -0.160  0.00  0.00    -0.265 OA
ATOM      4  N   LIG    1       -3.234   1.164   0.123  0.00  0.00    -0.179 N 
ATOM      5  C   LIG    1       -2.258   2.130   0.250  0.00  0.00    +0.156 A 
ATOM      6  C   LIG    1       -2.907   3.325   0.433  0.00  0.00    +0.114 A 
ATOM      7  C   LIG    1       -4.274   2.997   0.405  0.00  0.00    +0.156 A 
ATOM      8  N   LIG    1       -0.967   1.740   0.179  0.00  0.00    -0.338 N 
ATOM      9  H   LIG    1       -0.192   2.396   0.289  0.00  0.00    +0.167 HD
ATOM     10  N   LIG    1       -4.488   1.691   0.218  0.00  0.00    -0.169 NA
ATOM     11  C   LIG    1       -0.609   0.413  -0.019  0.00  0.00    +0.057 A 
ENDROOT
BRANCH  11  12
ATOM     12  C   LIG    1        0.849   0.198  -0.033  0.00  0.00    -0.001 A 
ATOM     13  C   LIG    1        1.512  -0.243   1.118  0.00  0.00    +0.010 A 
ATOM     14  C   LIG    1        2.898  -0.416   1.111  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1        3.647  -0.132  -0.042  0.00  0.00    +0.055 A 
ATOM     16  C   LIG    1        2.979   0.319  -1.190  0.00  0.00    +0.013 A 
ATOM     17  C   LIG    1        1.592   0.492  -1.183  0.00  0.00    +0.010 A 
BRANCH  15  18
ATOM     18  C   LIG    1        5.143  -0.343  -0.057  0.00  0.00    +0.417 C 
ATOM     19  F   LIG    1        5.792   0.500  -0.907  0.00  0.00    -0.166 F 
ATOM     20  F   LIG    1        5.482  -1.603  -0.446  0.00  0.00    -0.166 F 
ATOM     21  F   LIG    1        5.720  -0.158   1.163  0.00  0.00    -0.166 F 
ENDBRANCH  15  18
ENDBRANCH  11  12
BRANCH   1  23
ATOM     22  C   LIG    1       -0.139  -2.464  -1.333  0.00  0.00    +0.012 C 
ATOM     23  C   LIG    1       -1.301  -2.078  -0.412  0.00  0.00    +0.020 C 
ATOM     24  C   LIG    1       -1.217  -2.847   0.909  0.00  0.00    +0.012 C 
ENDBRANCH   1  23
BRANCH   6  25
ATOM     25  C   LIG    1       -2.321   4.606   0.612  0.00  0.00    +0.104 C 
ATOM     26  N   LIG    1       -1.829   5.647   0.757  0.00  0.00    -0.191 NA
ENDBRANCH   6  25
TORSDOF 4