REMARK  Name = BDB053425
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.595   1.605  -0.143  0.00  0.00    -0.268 OA
ATOM      2  C   LIG    1       -0.041   0.573  -0.179  0.00  0.00    +0.269 C 
ATOM      3  C   LIG    1        0.407  -0.844  -0.042  0.00  0.00    +0.130 C 
ATOM      4  C   LIG    1        1.647  -1.299   0.177  0.00  0.00    +0.041 C 
ATOM      5  N   LIG    1       -0.685  -1.679  -0.205  0.00  0.00    -0.213 NA
ATOM      6  C   LIG    1       -1.697  -0.881  -0.388  0.00  0.00    +0.192 C 
ATOM      7  N   LIG    1       -1.376   0.434  -0.377  0.00  0.00    -0.253 N 
ATOM      8  H   LIG    1       -1.993   1.201  -0.582  0.00  0.00    +0.158 HD
ENDROOT
BRANCH   4   9
ATOM      9  C   LIG    1        2.863  -0.502   0.354  0.00  0.00    -0.019 A 
ATOM     10  C   LIG    1        3.934  -0.694  -0.530  0.00  0.00    +0.057 A 
ATOM     11  C   LIG    1        5.083   0.041  -0.325  0.00  0.00    +0.167 A 
ATOM     12  O   LIG    1        6.209  -0.016  -1.086  0.00  0.00    -0.453 OA
ATOM     13  C   LIG    1        7.039   0.954  -0.415  0.00  0.00    +0.466 C 
ATOM     14  O   LIG    1        6.411   1.549   0.739  0.00  0.00    -0.453 OA
ATOM     15  C   LIG    1        5.199   0.933   0.716  0.00  0.00    +0.166 A 
ATOM     16  C   LIG    1        4.173   1.138   1.610  0.00  0.00    +0.050 A 
ATOM     17  C   LIG    1        2.994   0.406   1.427  0.00  0.00    +0.012 A 
ENDBRANCH   4   9
BRANCH   6  18
ATOM     18  N   LIG    1       -2.962  -1.321  -0.623  0.00  0.00    -0.287 N 
ATOM     19  H   LIG    1       -3.028  -2.330  -0.711  0.00  0.00    +0.155 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -4.186  -0.712  -0.298  0.00  0.00    +0.033 A 
ATOM     21  C   LIG    1       -4.312   0.332   0.627  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -5.553   0.927   0.876  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -6.687   0.489   0.198  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -6.582  -0.545  -0.727  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1       -5.341  -1.138  -0.972  0.00  0.00    +0.023 A 
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 3