REMARK  Name = BDB008971
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.248  -0.883  -0.136  0.00  0.00    +0.092 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.118   0.370  -0.029  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1       -2.576   0.239  -0.352  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -3.141  -1.075  -0.814  0.00  0.00    +0.037 C 
ATOM      5  C   LIG    1       -4.543  -0.953  -1.420  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1       -5.424  -0.032  -0.585  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1       -4.814   1.367  -0.479  0.00  0.00    +0.041 C 
ATOM      8  C   LIG    1       -3.332   1.343  -0.223  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1       -2.709   2.626   0.188  0.00  0.00    +0.268 A 
ATOM     10  O   LIG    1       -3.366   3.654   0.311  0.00  0.00    -0.266 OA
ATOM     11  N   LIG    1       -1.360   2.588   0.413  0.00  0.00    -0.243 N 
ATOM     12  H   LIG    1       -0.909   3.454   0.689  0.00  0.00    +0.192 HD
ATOM     13  N   LIG    1       -0.562   1.492   0.318  0.00  0.00    -0.175 NA
ENDBRANCH   1   2
BRANCH   1  18
ATOM     14  C   LIG    1        3.513  -0.550   0.309  0.00  0.00    +0.128 A 
ATOM     15  N   LIG    1        3.667  -0.576   1.653  0.00  0.00    -0.240 NA
ATOM     16  C   LIG    1        2.550  -0.692   2.404  0.00  0.00    +0.113 A 
ATOM     17  C   LIG    1        1.273  -0.798   1.881  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        1.120  -0.778   0.495  0.00  0.00    -0.037 A 
ATOM     19  C   LIG    1        2.265  -0.647  -0.299  0.00  0.00    +0.048 A 
BRANCH  14  22
ATOM     20  O   LIG    1        4.217  -0.457  -2.760  0.00  0.00    -0.275 OA
ATOM     21  C   LIG    1        4.914  -0.388  -1.774  0.00  0.00    +0.222 C 
ATOM     22  N   LIG    1        4.661  -0.424  -0.451  0.00  0.00    -0.256 N 
ATOM     23  C   LIG    1        6.036  -0.298  -0.007  0.00  0.00    +0.124 C 
ATOM     24  C   LIG    1        6.424  -0.234  -1.499  0.00  0.00    +0.116 C 
ENDBRANCH  14  22
ENDBRANCH   1  18
TORSDOF 3