REMARK  Name = BDB029362
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.269  -0.136  -0.361  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1        0.643   0.881  -0.032  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1        1.981   0.553   0.018  0.00  0.00    +0.038 A 
ATOM      4  N   LIG    1        3.046   1.387   0.320  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1        2.984   2.368   0.549  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1        4.253   0.700   0.272  0.00  0.00    +0.222 C 
ATOM      7  C   LIG    1        3.944  -0.753  -0.106  0.00  0.00    +0.133 C 
ATOM      8  O   LIG    1        5.354   1.177   0.493  0.00  0.00    -0.275 OA
ATOM      9  C   LIG    1        2.451  -0.731  -0.244  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1        1.576  -1.747  -0.573  0.00  0.00    +0.006 A 
ATOM     11  C   LIG    1        0.211  -1.441  -0.631  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  14
ATOM     12  C   LIG    1       -2.030  -0.267   2.060  0.00  0.00    +0.046 C 
ATOM     13  C   LIG    1       -2.543   0.093   0.697  0.00  0.00    -0.025 A 
ATOM     14  C   LIG    1       -1.707   0.152  -0.433  0.00  0.00    -0.012 A 
ATOM     15  C   LIG    1       -2.275   0.498  -1.667  0.00  0.00    +0.028 A 
ATOM     16  C   LIG    1       -3.630   0.772  -1.730  0.00  0.00    +0.111 A 
ATOM     17  N   LIG    1       -4.452   0.728  -0.665  0.00  0.00    -0.263 NA
ATOM     18  C   LIG    1       -3.892   0.391   0.518  0.00  0.00    +0.114 A 
ENDBRANCH   1  14
TORSDOF 1