REMARK  Name = BDB055863
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.457  -0.032  -0.021  0.00  0.00    +0.082 A 
ATOM      2  C   LIG    1        2.073   0.128   0.091  0.00  0.00    +0.104 A 
ATOM      3  C   LIG    1        1.584   1.103   0.956  0.00  0.00    +0.085 A 
ATOM      4  N   LIG    1        0.220   1.021   0.844  0.00  0.00    -0.340 N 
ATOM      5  H   LIG    1       -0.450   1.603   1.326  0.00  0.00    +0.167 HD
ATOM      6  C   LIG    1       -0.082   0.013  -0.041  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1        2.412   1.917   1.713  0.00  0.00    +0.138 A 
ATOM      8  N   LIG    1        3.752   1.755   1.608  0.00  0.00    -0.260 NA
ATOM      9  N   LIG    1        1.022  -0.545  -0.494  0.00  0.00    -0.231 NA
ATOM     10  C   LIG    1        4.237   0.815   0.756  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   6  11
ATOM     11  C   LIG    1       -1.484  -0.375  -0.411  0.00  0.00    +0.069 C 
ATOM     12  C   LIG    1       -2.234  -0.987   0.788  0.00  0.00    +0.092 C 
ATOM     13  N   LIG    1       -3.620  -1.339   0.462  0.00  0.00    -0.315 NA
ATOM     14  H   LIG    1       -4.080  -1.725   1.286  0.00  0.00    +0.122 HD
ATOM     15  C   LIG    1       -4.374  -0.192  -0.037  0.00  0.00    +0.081 C 
ATOM     16  C   LIG    1       -3.715   0.411  -1.276  0.00  0.00    +0.016 C 
ATOM     17  C   LIG    1       -2.267   0.809  -0.997  0.00  0.00    +0.014 C 
ENDBRANCH   6  11
BRANCH   1  21
ATOM     18  N   LIG    1        5.083  -1.768  -0.399  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1        5.201  -1.876   0.600  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1        5.397  -2.531  -0.986  0.00  0.00    +0.145 HD
ATOM     21  C   LIG    1        4.066  -1.012  -0.923  0.00  0.00    +0.245 C 
ATOM     22  O   LIG    1        3.714  -1.151  -2.085  0.00  0.00    -0.270 OA
ENDBRANCH   1  21
TORSDOF 2