REMARK  Name = BDB002142
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.676  -0.307   0.234  0.00  0.00    +0.121 A 
ATOM      2  C   LIG    1       -0.722   0.712   0.292  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        0.487   0.604  -0.403  0.00  0.00    +0.016 A 
ATOM      4  C   LIG    1        0.755  -0.540  -1.161  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -0.207  -1.556  -1.230  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1       -1.416  -1.443  -0.533  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.021  -0.714  -1.928  0.00  0.00    +0.244 C 
ATOM      8  N   LIG    1        3.104   0.013  -1.504  0.00  0.00    -0.306 N 
ATOM      9  H   LIG    1        3.108   0.509  -0.620  0.00  0.00    +0.149 HD
ATOM     10  O   LIG    1        2.072  -1.495  -2.873  0.00  0.00    -0.270 OA
BRANCH   8  11
ATOM     11  C   LIG    1        4.404  -0.140  -2.118  0.00  0.00    +0.160 C 
BRANCH  11  12
ATOM     12  C   LIG    1        5.438   0.751  -1.462  0.00  0.00    +0.058 A 
ATOM     13  N   LIG    1        5.089   1.389  -0.308  0.00  0.00    -0.258 NA
ATOM     14  C   LIG    1        6.026   2.167   0.275  0.00  0.00    +0.111 A 
ATOM     15  C   LIG    1        7.304   2.345  -0.228  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1        7.646   1.683  -1.401  0.00  0.00    +0.003 A 
ATOM     17  C   LIG    1        6.704   0.873  -2.029  0.00  0.00    +0.025 A 
ENDBRANCH  11  12
ENDBRANCH   8  11
ENDBRANCH   4   7
BRANCH   1  18
ATOM     18  O   LIG    1       -2.807  -0.066   0.962  0.00  0.00    -0.487 OA
BRANCH  18  19
ATOM     19  C   LIG    1       -3.827  -1.065   0.939  0.00  0.00    +0.269 C 
BRANCH  19  22
ATOM     20  C   LIG    1       -3.949  -0.952   4.184  0.00  0.00    +0.069 C 
ATOM     21  C   LIG    1       -5.020  -0.614   3.218  0.00  0.00    +0.087 A 
ATOM     22  C   LIG    1       -4.969  -0.655   1.798  0.00  0.00    +0.054 A 
ATOM     23  C   LIG    1       -6.219  -0.219   1.416  0.00  0.00    +0.141 A 
ATOM     24  C   LIG    1       -6.877   0.008   0.116  0.00  0.00    +0.089 C 
ATOM     25  O   LIG    1       -6.967   0.038   2.520  0.00  0.00    -0.359 OA
ATOM     26  N   LIG    1       -6.219  -0.210   3.654  0.00  0.00    -0.083 NA
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 6