REMARK  Name = BDB003711
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.397   0.428  -1.473  0.00  0.00    +0.162 A 
ATOM      2  C   LIG    1       -3.498  -0.356  -2.203  0.00  0.00    +0.159 A 
ATOM      3  C   LIG    1       -2.166  -0.500  -1.823  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1       -1.699   0.143  -0.672  0.00  0.00    -0.023 A 
ATOM      5  C   LIG    1       -0.245   0.119  -0.199  0.00  0.00    +0.092 C 
ATOM      6  N   LIG    1       -0.139  -0.052   1.267  0.00  0.00    -0.291 NA
ATOM      7  C   LIG    1       -1.128   0.692   2.064  0.00  0.00    +0.090 C 
ATOM      8  C   LIG    1       -2.064   1.630   1.290  0.00  0.00    +0.051 C 
ATOM      9  C   LIG    1        1.234   0.227   1.728  0.00  0.00    +0.124 C 
ATOM     10  C   LIG    1        2.301  -0.495   0.941  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1        2.019  -1.049  -0.317  0.00  0.00    -0.037 A 
ATOM     12  C   LIG    1        3.027  -1.712  -1.033  0.00  0.00    +0.008 A 
ATOM     13  C   LIG    1        4.326  -1.802  -0.522  0.00  0.00    +0.049 A 
ATOM     14  C   LIG    1        4.628  -1.229   0.711  0.00  0.00    +0.162 A 
ATOM     15  C   LIG    1        3.611  -0.578   1.425  0.00  0.00    +0.163 A 
ATOM     16  C   LIG    1        0.618  -0.973  -0.877  0.00  0.00    +0.059 C 
ATOM     17  C   LIG    1       -2.603   0.934   0.069  0.00  0.00    -0.038 A 
ATOM     18  C   LIG    1       -3.941   1.082  -0.332  0.00  0.00    +0.053 A 
ENDROOT
BRANCH   1  20
ATOM     19  C   LIG    1       -6.620   1.238  -1.247  0.00  0.00    +0.277 C 
ATOM     20  O   LIG    1       -5.671   0.473  -1.981  0.00  0.00    -0.491 OA
ENDBRANCH   1  20
BRANCH   2  21
ATOM     21  O   LIG    1       -3.916  -1.005  -3.335  0.00  0.00    -0.503 OA
ATOM     22  H   LIG    1       -4.863  -0.779  -3.415  0.00  0.00    +0.292 HD
ENDBRANCH   2  21
BRANCH  14  23
ATOM     23  O   LIG    1        5.855  -1.230   1.325  0.00  0.00    -0.491 OA
ATOM     24  C   LIG    1        6.907  -1.900   0.640  0.00  0.00    +0.277 C 
ENDBRANCH  14  23
BRANCH  15  25
ATOM     25  O   LIG    1        3.914  -0.001   2.634  0.00  0.00    -0.503 OA
ATOM     26  H   LIG    1        4.862  -0.197   2.771  0.00  0.00    +0.292 HD
ENDBRANCH  15  25
TORSDOF 4