REMARK  Name = BDB048406
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.807   0.605  -0.456  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1        1.506   0.955  -0.066  0.00  0.00    +0.033 A 
ATOM      3  C   LIG    1        0.448   0.026  -0.076  0.00  0.00    +0.008 A 
ATOM      4  C   LIG    1        0.758  -1.293  -0.452  0.00  0.00    +0.050 A 
ATOM      5  N   LIG    1       -0.246  -2.267  -0.485  0.00  0.00    -0.322 N 
ATOM      6  H   LIG    1       -0.027  -3.216  -0.754  0.00  0.00    +0.169 HD
ATOM      7  C   LIG    1       -1.560  -2.034  -0.167  0.00  0.00    +0.257 A 
ATOM      8  C   LIG    1       -1.931  -0.655   0.243  0.00  0.00    +0.047 A 
ATOM      9  C   LIG    1       -3.269  -0.396   0.579  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -3.654   0.883   0.969  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1       -2.705   1.897   1.024  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -1.370   1.637   0.689  0.00  0.00    +0.009 A 
ATOM     13  O   LIG    1       -2.391  -2.935  -0.221  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1        2.060  -1.671  -0.786  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1       -0.948   0.354   0.290  0.00  0.00    -0.004 A 
ATOM     16  C   LIG    1        3.082  -0.725  -0.765  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  17
ATOM     17  N   LIG    1        3.853   1.526  -0.321  0.00  0.00    -0.358 N 
ATOM     18  H   LIG    1        3.568   2.496  -0.410  0.00  0.00    +0.142 HD
ATOM     19  H   LIG    1        4.668   1.312  -0.888  0.00  0.00    +0.142 HD
ENDBRANCH   1  17
TORSDOF 1