REMARK  Name = BDB001734
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.494  -0.433   3.057  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        1.471  -0.180   1.855  0.00  0.00    +0.247 C 
ATOM      3  N   LIG    1        0.327  -0.292   1.075  0.00  0.00    -0.295 N 
ATOM      4  C   LIG    1       -0.886  -0.821   1.701  0.00  0.00    +0.127 C 
ATOM      5  C   LIG    1       -1.900  -1.371   0.683  0.00  0.00    +0.124 C 
ATOM      6  N   LIG    1       -2.238  -0.377  -0.355  0.00  0.00    -0.327 N 
ATOM      7  C   LIG    1       -1.294   0.735  -0.550  0.00  0.00    +0.124 C 
ATOM      8  C   LIG    1        0.157   0.301  -0.259  0.00  0.00    +0.127 C 
ENDROOT
BRANCH   2   9
ATOM      9  C   LIG    1        2.733   0.268   1.222  0.00  0.00    +0.041 A 
ATOM     10  C   LIG    1        3.236  -0.389   0.092  0.00  0.00    +0.062 A 
ATOM     11  C   LIG    1        4.427   0.072  -0.427  0.00  0.00    +0.167 A 
ATOM     12  O   LIG    1        5.062  -0.429  -1.520  0.00  0.00    -0.453 OA
ATOM     13  C   LIG    1        6.231   0.416  -1.568  0.00  0.00    +0.466 C 
ATOM     14  O   LIG    1        6.260   1.413  -0.526  0.00  0.00    -0.453 OA
ATOM     15  C   LIG    1        5.111   1.123   0.141  0.00  0.00    +0.166 A 
ATOM     16  C   LIG    1        4.649   1.772   1.267  0.00  0.00    +0.050 A 
ATOM     17  C   LIG    1        3.444   1.330   1.820  0.00  0.00    +0.017 A 
ENDBRANCH   2   9
BRANCH   6  18
ATOM     18  C   LIG    1       -3.476  -0.399  -0.979  0.00  0.00    +0.030 A 
ATOM     19  C   LIG    1       -4.044   0.753  -1.552  0.00  0.00    +0.026 A 
ATOM     20  C   LIG    1       -5.293   0.726  -2.186  0.00  0.00    +0.040 A 
ATOM     21  C   LIG    1       -5.996  -0.465  -2.261  0.00  0.00    +0.124 A 
ATOM     22  F   LIG    1       -7.189  -0.494  -2.867  0.00  0.00    -0.205 F 
ATOM     23  C   LIG    1       -5.473  -1.624  -1.714  0.00  0.00    +0.040 A 
ATOM     24  C   LIG    1       -4.225  -1.587  -1.082  0.00  0.00    +0.026 A 
ENDBRANCH   6  18
TORSDOF 2