REMARK  Name = BDB000013
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.913  -3.724   0.289  0.00  0.00    -0.244 OA
ATOM      2  C   LIG    1        0.449  -2.595   0.209  0.00  0.00    +0.345 A 
ATOM      3  C   LIG    1        1.324  -1.399   0.111  0.00  0.00    +0.074 A 
ATOM      4  C   LIG    1        0.752  -0.128   0.012  0.00  0.00    +0.047 A 
ATOM      5  C   LIG    1        1.575   0.989  -0.086  0.00  0.00    +0.185 A 
ATOM      6  C   LIG    1        2.957   0.858  -0.085  0.00  0.00    +0.202 A 
ATOM      7  C   LIG    1        3.520  -0.410   0.014  0.00  0.00    +0.163 A 
ATOM      8  O   LIG    1        1.017   2.280  -0.191  0.00  0.00    -0.418 OA
ATOM      9  C   LIG    1       -0.362   2.511  -0.204  0.00  0.00    +0.345 A 
ATOM     10  O   LIG    1       -0.819   3.642  -0.299  0.00  0.00    -0.244 OA
ATOM     11  C   LIG    1       -1.240   1.318  -0.097  0.00  0.00    +0.074 A 
ATOM     12  C   LIG    1       -2.633   1.468  -0.093  0.00  0.00    +0.065 A 
ATOM     13  C   LIG    1       -3.439   0.339   0.022  0.00  0.00    +0.163 A 
ATOM     14  C   LIG    1       -2.880  -0.934   0.102  0.00  0.00    +0.202 A 
ATOM     15  C   LIG    1       -1.497  -1.070   0.109  0.00  0.00    +0.185 A 
ATOM     16  C   LIG    1       -0.672   0.045   0.010  0.00  0.00    +0.047 A 
ATOM     17  C   LIG    1        2.719  -1.544   0.112  0.00  0.00    +0.065 A 
ATOM     18  O   LIG    1       -0.928  -2.360   0.198  0.00  0.00    -0.418 OA
ENDROOT
BRANCH   7  19
ATOM     19  O   LIG    1        4.877  -0.556   0.016  0.00  0.00    -0.503 OA
ATOM     20  H   LIG    1        5.236   0.351  -0.060  0.00  0.00    +0.292 HD
ENDBRANCH   7  19
BRANCH   6  21
ATOM     21  O   LIG    1        3.790   1.937  -0.180  0.00  0.00    -0.501 OA
ATOM     22  H   LIG    1        3.225   2.732  -0.241  0.00  0.00    +0.292 HD
ENDBRANCH   6  21
BRANCH  13  23
ATOM     23  O   LIG    1       -4.792   0.507   0.083  0.00  0.00    -0.503 OA
ATOM     24  H   LIG    1       -5.146  -0.228   0.618  0.00  0.00    +0.292 HD
ENDBRANCH  13  23
BRANCH  14  25
ATOM     25  O   LIG    1       -3.688  -2.030   0.157  0.00  0.00    -0.501 OA
ATOM     26  H   LIG    1       -4.350  -1.929  -0.552  0.00  0.00    +0.292 HD
ENDBRANCH  14  25
TORSDOF 4