REMARK  Name = BDB031325
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -5.363   0.883  -0.375  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1       -4.977  -0.442  -0.152  0.00  0.00    +0.028 A 
ATOM      3  C   LIG    1       -3.630  -0.732   0.026  0.00  0.00    -0.023 A 
ATOM      4  C   LIG    1       -3.024  -2.075   0.265  0.00  0.00    +0.056 C 
ATOM      5  C   LIG    1       -1.545  -1.724   0.459  0.00  0.00    +0.120 C 
ATOM      6  N   LIG    1       -1.374  -0.290   0.163  0.00  0.00    -0.255 N 
ATOM      7  C   LIG    1       -0.172   0.412   0.089  0.00  0.00    +0.311 C 
ATOM      8  N   LIG    1        0.935  -0.352   0.425  0.00  0.00    -0.269 N 
ATOM      9  H   LIG    1        0.745  -1.208   0.917  0.00  0.00    +0.156 HD
ATOM     10  O   LIG    1       -0.100   1.592  -0.243  0.00  0.00    -0.252 OA
ATOM     11  C   LIG    1       -2.654   0.261  -0.059  0.00  0.00    +0.041 A 
ATOM     12  C   LIG    1       -3.014   1.567  -0.339  0.00  0.00    +0.025 A 
ATOM     13  C   LIG    1       -4.371   1.867  -0.517  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   8  14
ATOM     14  C   LIG    1        2.298   0.010   0.336  0.00  0.00    +0.037 A 
ATOM     15  C   LIG    1        3.224  -0.874   0.917  0.00  0.00    +0.051 A 
ATOM     16  C   LIG    1        4.557  -0.541   0.830  0.00  0.00    +0.069 A 
ATOM     17  C   LIG    1        4.994   0.615   0.191  0.00  0.00    +0.067 A 
ATOM     18  N   LIG    1        6.381   0.655   0.277  0.00  0.00    -0.306 N 
ATOM     19  H   LIG    1        6.994   1.365  -0.088  0.00  0.00    +0.170 HD
ATOM     20  C   LIG    1        6.822  -0.479   0.973  0.00  0.00    +0.325 A 
ATOM     21  O   LIG    1        7.974  -0.771   1.235  0.00  0.00    -0.247 OA
ATOM     22  C   LIG    1        4.122   1.496  -0.395  0.00  0.00    +0.029 A 
ATOM     23  N   LIG    1        5.676  -1.214   1.310  0.00  0.00    -0.306 N 
ATOM     24  H   LIG    1        5.701  -2.082   1.819  0.00  0.00    +0.170 HD
ATOM     25  C   LIG    1        2.756   1.179  -0.319  0.00  0.00    +0.025 A 
ENDBRANCH   8  14
BRANCH   1  26
ATOM     26  N   LIG    1       -6.697   1.185  -0.675  0.00  0.00    -0.358 N 
ATOM     27  H   LIG    1       -7.368   0.550  -0.253  0.00  0.00    +0.142 HD
ATOM     28  H   LIG    1       -6.939   2.159  -0.524  0.00  0.00    +0.142 HD
ENDBRANCH   1  26
TORSDOF 2