REMARK  Name = BDB000661
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        4.039   1.216   0.180  0.00  0.00    -0.283 OA
ATOM      2  C   LIG    1        3.034   0.560   0.051  0.00  0.00    +0.234 C 
ATOM      3  C   LIG    1        1.643   1.020   0.195  0.00  0.00    +0.034 A 
ATOM      4  C   LIG    1        0.788  -0.050  -0.034  0.00  0.00    +0.008 A 
ATOM      5  C   LIG    1       -0.613   0.039   0.026  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1       -1.075   1.383   0.297  0.00  0.00    +0.136 A 
ATOM      7  C   LIG    1       -0.195   2.472   0.542  0.00  0.00    +0.034 A 
ATOM      8  C   LIG    1       -1.261  -1.236  -0.198  0.00  0.00    +0.136 A 
ATOM      9  C   LIG    1       -0.549  -2.425  -0.510  0.00  0.00    +0.034 A 
ATOM     10  C   LIG    1        0.843  -2.414  -0.586  0.00  0.00    +0.015 A 
ATOM     11  C   LIG    1        1.480  -1.217  -0.328  0.00  0.00    +0.034 A 
ATOM     12  C   LIG    1        1.186   2.286   0.500  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1        2.924  -0.936  -0.304  0.00  0.00    +0.234 C 
ATOM     14  O   LIG    1        3.825  -1.712  -0.514  0.00  0.00    -0.283 OA
ENDROOT
BRANCH   6  15
ATOM     15  N   LIG    1       -2.486   1.727   0.195  0.00  0.00    +0.057 N 
ATOM     16  O   LIG    1       -2.976   2.390   1.115  0.00  0.00    -0.126 OA
ATOM     17  O   LIG    1       -3.063   1.372  -0.840  0.00  0.00    -0.126 OA
ENDBRANCH   6  15
BRANCH   8  18
ATOM     18  N   LIG    1       -2.690  -1.400   0.026  0.00  0.00    +0.057 N 
ATOM     19  O   LIG    1       -3.129  -0.981   1.104  0.00  0.00    -0.126 OA
ATOM     20  O   LIG    1       -3.336  -1.992  -0.847  0.00  0.00    -0.126 OA
ENDBRANCH   8  18
TORSDOF 2