REMARK  Name = BDB065193
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.586   0.195   2.133  0.00  0.00    -0.268 OA
ATOM      2  C   LIG    1        0.566  -0.521   1.127  0.00  0.00    +0.268 C 
ATOM      3  N   LIG    1       -0.631  -1.137   0.720  0.00  0.00    -0.290 N 
ATOM      4  C   LIG    1       -1.826  -0.880   1.512  0.00  0.00    +0.145 C 
ATOM      5  C   LIG    1       -2.679   0.209   0.909  0.00  0.00    -0.007 A 
ATOM      6  C   LIG    1       -3.207   0.130  -0.394  0.00  0.00    +0.032 A 
ATOM      7  C   LIG    1       -4.016   1.194  -0.847  0.00  0.00    +0.026 A 
ATOM      8  C   LIG    1       -4.258   2.323  -0.063  0.00  0.00    +0.040 A 
ATOM      9  C   LIG    1       -3.702   2.395   1.201  0.00  0.00    +0.124 A 
ATOM     10  F   LIG    1       -3.925   3.474   1.962  0.00  0.00    -0.205 F 
ATOM     11  N   LIG    1       -3.080  -0.960  -1.251  0.00  0.00    -0.342 N 
ATOM     12  H   LIG    1       -3.082  -0.687  -2.231  0.00  0.00    +0.146 HD
ATOM     13  C   LIG    1       -2.253  -2.130  -0.974  0.00  0.00    +0.120 C 
ATOM     14  C   LIG    1       -2.923   1.357   1.691  0.00  0.00    +0.045 A 
ATOM     15  C   LIG    1       -0.807  -1.795  -0.579  0.00  0.00    +0.127 C 
ENDROOT
BRANCH   2  16
ATOM     16  C   LIG    1        1.817  -0.730   0.353  0.00  0.00    +0.155 A 
ATOM     17  C   LIG    1        2.998   0.081   0.451  0.00  0.00    +0.032 A 
ATOM     18  C   LIG    1        3.917  -0.494  -0.417  0.00  0.00    +0.066 A 
ATOM     19  C   LIG    1        5.207   0.009  -0.616  0.00  0.00    +0.028 A 
ATOM     20  C   LIG    1        5.564   1.151   0.108  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        4.668   1.754   0.989  0.00  0.00    +0.001 A 
ATOM     22  N   LIG    1        3.274  -1.572  -0.951  0.00  0.00    -0.276 N 
ATOM     23  H   LIG    1        3.644  -2.234  -1.622  0.00  0.00    +0.189 HD
ATOM     24  C   LIG    1        3.382   1.231   1.171  0.00  0.00    +0.012 A 
ATOM     25  N   LIG    1        2.017  -1.745  -0.515  0.00  0.00    -0.168 NA
ENDBRANCH   2  16
TORSDOF 1