REMARK  Name = BDB031258
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.611  -0.241  -0.108  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        2.699  -0.479  -0.963  0.00  0.00    +0.040 A 
ATOM      3  C   LIG    1        3.951  -0.243  -0.450  0.00  0.00    +0.068 A 
ATOM      4  C   LIG    1        4.150   0.201   0.856  0.00  0.00    +0.067 A 
ATOM      5  N   LIG    1        5.519   0.337   1.058  0.00  0.00    -0.306 N 
ATOM      6  H   LIG    1        5.990   0.633   1.897  0.00  0.00    +0.170 HD
ATOM      7  C   LIG    1        6.187  -0.023  -0.122  0.00  0.00    +0.325 A 
ATOM      8  O   LIG    1        7.391  -0.025  -0.302  0.00  0.00    -0.247 OA
ATOM      9  C   LIG    1        3.108   0.427   1.722  0.00  0.00    +0.028 A 
ATOM     10  N   LIG    1        5.198  -0.380  -1.050  0.00  0.00    -0.306 N 
ATOM     11  H   LIG    1        5.395  -0.689  -1.988  0.00  0.00    +0.170 HD
ATOM     12  C   LIG    1        1.817   0.196   1.228  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  14
ATOM     13  O   LIG    1        0.079  -1.359  -1.497  0.00  0.00    -0.270 OA
ATOM     14  C   LIG    1        0.246  -0.495  -0.643  0.00  0.00    +0.244 C 
ATOM     15  N   LIG    1       -0.767   0.298  -0.149  0.00  0.00    -0.308 N 
ATOM     16  H   LIG    1       -0.569   1.001   0.549  0.00  0.00    +0.149 HD
BRANCH  15  17
ATOM     17  C   LIG    1       -2.161   0.077  -0.517  0.00  0.00    +0.076 C 
ATOM     18  C   LIG    1       -2.780  -1.034   0.336  0.00  0.00    +0.037 C 
ATOM     19  C   LIG    1       -4.265  -1.194   0.023  0.00  0.00    +0.082 C 
ATOM     20  N   LIG    1       -4.984   0.069   0.199  0.00  0.00    -0.316 NA
ATOM     21  H   LIG    1       -5.970  -0.075  -0.019  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1       -4.446   1.117  -0.669  0.00  0.00    +0.082 C 
ATOM     23  C   LIG    1       -2.970   1.368  -0.378  0.00  0.00    +0.037 C 
ENDBRANCH  15  17
ENDBRANCH   1  14
TORSDOF 2