REMARK  Name = BDB003823
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.123  -0.310  -0.540  0.00  0.00    +0.229 C 
ATOM      2  N   LIG    1       -1.264  -0.357   0.247  0.00  0.00    -0.285 N 
ATOM      3  H   LIG    1       -1.134  -0.485   1.243  0.00  0.00    +0.155 HD
ATOM      4  O   LIG    1       -0.088  -0.178  -1.759  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   1  11
ATOM      5  O   LIG    1        5.344  -0.910  -0.232  0.00  0.00    -0.275 OA
ATOM      6  C   LIG    1        4.288  -0.284  -0.285  0.00  0.00    +0.219 C 
ATOM      7  N   LIG    1        3.248  -0.741  -1.046  0.00  0.00    -0.256 N 
ATOM      8  H   LIG    1        3.642  -1.536  -1.544  0.00  0.00    +0.157 HD
ATOM      9  C   LIG    1        2.168  -1.272  -0.401  0.00  0.00    +0.231 C 
ATOM     10  O   LIG    1        1.997  -2.492  -0.410  0.00  0.00    -0.275 OA
ATOM     11  C   LIG    1        1.165  -0.356   0.272  0.00  0.00    +0.161 C 
ATOM     12  C   LIG    1        1.606   1.082   0.543  0.00  0.00    +0.022 C 
ATOM     13  C   LIG    1        2.922   1.167   1.305  0.00  0.00    +0.010 C 
ATOM     14  C   LIG    1        4.124   1.058   0.384  0.00  0.00    +0.096 C 
ENDBRANCH   1  11
BRANCH   2  15
ATOM     15  C   LIG    1       -2.606  -0.290  -0.183  0.00  0.00    +0.034 A 
ATOM     16  C   LIG    1       -2.995  -0.136  -1.517  0.00  0.00    +0.026 A 
ATOM     17  C   LIG    1       -4.351  -0.076  -1.858  0.00  0.00    +0.040 A 
ATOM     18  C   LIG    1       -5.316  -0.169  -0.865  0.00  0.00    +0.124 A 
ATOM     19  F   LIG    1       -6.613  -0.110  -1.192  0.00  0.00    -0.205 F 
ATOM     20  C   LIG    1       -4.952  -0.322   0.466  0.00  0.00    +0.040 A 
ATOM     21  C   LIG    1       -3.598  -0.383   0.806  0.00  0.00    +0.026 A 
ENDBRANCH   2  15
TORSDOF 2