REMARK  Name = BDB059713
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.273  -0.060  -0.193  0.00  0.00    +0.099 A 
ATOM      2  C   LIG    1        1.873  -0.028  -0.373  0.00  0.00    +0.104 A 
ATOM      3  C   LIG    1        1.349  -0.072  -1.667  0.00  0.00    +0.067 A 
ATOM      4  N   LIG    1       -0.013  -0.024  -1.498  0.00  0.00    -0.342 N 
ATOM      5  H   LIG    1       -0.701  -0.040  -2.238  0.00  0.00    +0.167 HD
ATOM      6  C   LIG    1       -0.282   0.039  -0.155  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1        2.131  -0.149  -2.820  0.00  0.00    +0.030 A 
ATOM      8  C   LIG    1        3.512  -0.184  -2.632  0.00  0.00    +0.041 A 
ATOM      9  N   LIG    1        0.837   0.036   0.536  0.00  0.00    -0.231 NA
ATOM     10  C   LIG    1        4.064  -0.140  -1.351  0.00  0.00    +0.138 A 
ATOM     11  F   LIG    1        5.405  -0.175  -1.267  0.00  0.00    -0.205 F 
ENDROOT
BRANCH   6  12
ATOM     12  C   LIG    1       -1.668   0.107   0.414  0.00  0.00    +0.069 C 
ATOM     13  C   LIG    1       -2.412   1.374  -0.042  0.00  0.00    +0.092 C 
ATOM     14  N   LIG    1       -3.770   1.522   0.494  0.00  0.00    -0.315 NA
ATOM     15  H   LIG    1       -3.774   2.227   1.232  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1       -4.345   0.283   1.018  0.00  0.00    +0.081 C 
ATOM     17  C   LIG    1       -3.989  -0.921   0.154  0.00  0.00    +0.016 C 
ATOM     18  C   LIG    1       -2.478  -1.160   0.097  0.00  0.00    +0.014 C 
ENDBRANCH   6  12
BRANCH   1  22
ATOM     19  N   LIG    1        5.211  -0.206   1.291  0.00  0.00    -0.325 N 
ATOM     20  H   LIG    1        5.832  -0.324   0.500  0.00  0.00    +0.145 HD
ATOM     21  H   LIG    1        5.609  -0.127   2.217  0.00  0.00    +0.145 HD
ATOM     22  C   LIG    1        3.862  -0.005   1.169  0.00  0.00    +0.246 C 
ATOM     23  O   LIG    1        3.209   0.215   2.181  0.00  0.00    -0.270 OA
ENDBRANCH   1  22
TORSDOF 2