REMARK  Name = BDB001020
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.943   0.080   0.140  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1        2.779  -0.663   0.370  0.00  0.00    +0.033 A 
ATOM      3  C   LIG    1        1.551  -0.084   0.092  0.00  0.00    +0.004 A 
ATOM      4  C   LIG    1        0.198  -0.587   0.246  0.00  0.00    +0.054 A 
ATOM      5  C   LIG    1       -0.665   0.348  -0.175  0.00  0.00    -0.011 A 
ATOM      6  C   LIG    1        0.027   1.589  -0.666  0.00  0.00    +0.073 C 
ATOM      7  C   LIG    1       -2.098   0.081  -0.119  0.00  0.00    -0.007 A 
ATOM      8  C   LIG    1       -2.524  -1.167   0.383  0.00  0.00    +0.047 A 
ATOM      9  C   LIG    1       -3.886  -1.476   0.460  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -4.831  -0.543   0.035  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1       -4.417   0.694  -0.463  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -1.509  -2.168   0.839  0.00  0.00    +0.257 A 
ATOM     13  O   LIG    1       -1.836  -3.264   1.282  0.00  0.00    -0.267 OA
ATOM     14  C   LIG    1       -3.057   1.007  -0.541  0.00  0.00    +0.009 A 
ATOM     15  N   LIG    1       -0.184  -1.794   0.733  0.00  0.00    -0.321 N 
ATOM     16  H   LIG    1        0.502  -2.471   1.038  0.00  0.00    +0.169 HD
ATOM     17  C   LIG    1        1.468   1.208  -0.453  0.00  0.00    -0.034 A 
ATOM     18  C   LIG    1        2.608   1.937  -0.741  0.00  0.00    +0.006 A 
ATOM     19  C   LIG    1        3.847   1.352  -0.459  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1  20
ATOM     20  N   LIG    1        5.200  -0.520   0.299  0.00  0.00    -0.358 N 
ATOM     21  H   LIG    1        5.959   0.143   0.419  0.00  0.00    +0.142 HD
ATOM     22  H   LIG    1        5.219  -1.258   0.996  0.00  0.00    +0.142 HD
ENDBRANCH   1  20
TORSDOF 1