REMARK  Name = BDB048457
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -3.599   1.564   0.161  0.00  0.00    -0.245 OA
ATOM      2  C   LIG    1       -2.607   0.855   0.039  0.00  0.00    +0.337 A 
ATOM      3  O   LIG    1       -1.325   1.335   0.271  0.00  0.00    -0.418 OA
ATOM      4  C   LIG    1       -0.202   0.499   0.124  0.00  0.00    +0.184 A 
ATOM      5  C   LIG    1       -0.340  -0.835  -0.259  0.00  0.00    +0.022 A 
ATOM      6  C   LIG    1        0.807  -1.627  -0.392  0.00  0.00    +0.015 A 
ATOM      7  C   LIG    1        2.072  -1.081  -0.143  0.00  0.00    +0.050 A 
ATOM      8  C   LIG    1        2.182   0.251   0.237  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1       -1.673  -1.359  -0.507  0.00  0.00    +0.018 A 
ATOM     10  C   LIG    1        1.051   1.046   0.373  0.00  0.00    +0.202 A 
ATOM     11  C   LIG    1       -2.732  -0.556  -0.365  0.00  0.00    +0.092 A 
ENDROOT
BRANCH   8  12
ATOM     12  O   LIG    1        3.419   0.774   0.478  0.00  0.00    -0.503 OA
ATOM     13  H   LIG    1        3.254   1.706   0.726  0.00  0.00    +0.292 HD
ENDBRANCH   8  12
BRANCH  10  14
ATOM     14  O   LIG    1        1.212   2.352   0.749  0.00  0.00    -0.501 OA
ATOM     15  H   LIG    1        0.317   2.741   0.789  0.00  0.00    +0.292 HD
ENDBRANCH  10  14
TORSDOF 2