REMARK  Name = BDB003224
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.319  -2.233   3.404  0.00  0.00    -0.284 OA
ATOM      2  C   LIG    1        1.522  -1.477   2.465  0.00  0.00    +0.228 C 
ATOM      3  C   LIG    1        2.904  -0.937   2.167  0.00  0.00    +0.233 C 
ATOM      4  O   LIG    1        3.829  -1.132   2.944  0.00  0.00    -0.283 OA
ATOM      5  C   LIG    1        3.088  -0.181   0.916  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1        1.983   0.101   0.097  0.00  0.00    +0.007 A 
ATOM      7  C   LIG    1        2.239   0.781  -1.111  0.00  0.00    +0.010 A 
ATOM      8  C   LIG    1        3.531   1.185  -1.465  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1        4.604   0.914  -0.624  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        0.598  -0.314   0.479  0.00  0.00    +0.043 C 
ATOM     11  C   LIG    1        4.386   0.228   0.566  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1        0.419  -1.051   1.588  0.00  0.00    +0.078 C 
ENDROOT
BRANCH  10  13
ATOM     13  N   LIG    1       -0.429   0.151  -0.333  0.00  0.00    -0.313 N 
ATOM     14  H   LIG    1       -0.339   1.152  -0.550  0.00  0.00    +0.152 HD
BRANCH  13  15
ATOM     15  C   LIG    1       -1.771  -0.298  -0.428  0.00  0.00    +0.045 A 
ATOM     16  C   LIG    1       -2.842   0.606  -0.628  0.00  0.00    +0.080 A 
ATOM     17  C   LIG    1       -4.164   0.133  -0.708  0.00  0.00    +0.017 A 
ATOM     18  C   LIG    1       -4.434  -1.231  -0.604  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1       -3.389  -2.131  -0.430  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1       -2.073  -1.669  -0.348  0.00  0.00    +0.024 A 
BRANCH  16  21
ATOM     21  C   LIG    1       -2.568   2.062  -0.762  0.00  0.00    +0.339 C 
ATOM     22  O   LIG    1       -1.461   2.572  -0.810  0.00  0.00    -0.245 OA
BRANCH  21  23
ATOM     23  O   LIG    1       -3.682   2.814  -0.826  0.00  0.00    -0.477 OA
ATOM     24  H   LIG    1       -3.354   3.735  -0.903  0.00  0.00    +0.295 HD
ENDBRANCH  21  23
ENDBRANCH  16  21
ENDBRANCH  13  15
ENDBRANCH  10  13
TORSDOF 4