REMARK  Name = BDB014462
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.615  -1.421  -2.106  0.00  0.00    +0.145 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        1.354  -2.231  -3.031  0.00  0.00    -0.389 OA
ATOM      3  H   LIG    1        0.753  -2.937  -3.327  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1        0.213  -2.255  -0.876  0.00  0.00    +0.136 C 
BRANCH   4   7
ATOM      5  O   LIG    1       -2.447  -1.367  -0.968  0.00  0.00    -0.276 OA
ATOM      6  C   LIG    1       -1.763  -1.068   0.003  0.00  0.00    +0.213 C 
ATOM      7  N   LIG    1       -0.464  -1.501   0.159  0.00  0.00    -0.313 N 
ATOM      8  H   LIG    1        0.129  -1.043   0.843  0.00  0.00    +0.149 HD
BRANCH   6   9
ATOM      9  C   LIG    1       -2.229  -0.197   1.160  0.00  0.00    +0.099 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -3.645   0.388   1.051  0.00  0.00    -0.002 C 
ATOM     11  C   LIG    1       -4.744  -0.691   1.108  0.00  0.00    +0.004 C 
ATOM     12  C   LIG    1       -6.054  -0.260   0.444  0.00  0.00    +0.000 C 
ATOM     13  C   LIG    1       -6.286   1.239   0.566  0.00  0.00    +0.000 C 
ATOM     14  C   LIG    1       -5.175   2.048  -0.105  0.00  0.00    +0.000 C 
ATOM     15  C   LIG    1       -3.826   1.323  -0.151  0.00  0.00    +0.004 C 
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   4   7
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1        1.417  -0.138  -1.763  0.00  0.00    +0.117 C 
BRANCH  16  17
ATOM     17  N   LIG    1        2.441  -0.263  -0.701  0.00  0.00    -0.295 NA
ATOM     18  C   LIG    1        2.925   1.084  -0.327  0.00  0.00    +0.120 C 
ATOM     19  C   LIG    1        4.069   1.064   0.664  0.00  0.00    -0.030 A 
ATOM     20  C   LIG    1        4.881  -0.074   0.801  0.00  0.00    -0.042 A 
ATOM     21  C   LIG    1        5.956  -0.060   1.700  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1        6.239   1.087   2.440  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        5.449   2.225   2.292  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        4.555  -1.327   0.029  0.00  0.00    +0.051 C 
ATOM     25  C   LIG    1        4.371   2.215   1.407  0.00  0.00    +0.005 A 
ATOM     26  C   LIG    1        3.590  -1.077  -1.140  0.00  0.00    +0.089 C 
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7