REMARK  Name = BDB020211
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.680  -0.451  -0.251  0.00  0.00    +0.126 C 
ATOM      2  C   LIG    1       -1.460  -1.077   0.901  0.00  0.00    +0.228 C 
ATOM      3  O   LIG    1       -0.971  -1.804   1.765  0.00  0.00    -0.275 OA
ATOM      4  N   LIG    1       -2.818  -0.843   0.914  0.00  0.00    -0.256 N 
ATOM      5  H   LIG    1       -3.333  -1.284   1.664  0.00  0.00    +0.157 HD
ATOM      6  C   LIG    1       -3.561  -0.092   0.038  0.00  0.00    +0.219 C 
ATOM      7  O   LIG    1       -4.779   0.001   0.157  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1       -2.808   0.549  -1.100  0.00  0.00    +0.097 C 
ATOM      9  C   LIG    1       -1.369   0.840  -0.705  0.00  0.00    +0.028 C 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        4.069   0.025  -1.018  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1        2.838   0.035  -0.267  0.00  0.00    -0.274 N 
ATOM     12  N   LIG    1        1.681  -0.259  -0.888  0.00  0.00    -0.176 NA
ATOM     13  C   LIG    1        0.758  -0.191   0.085  0.00  0.00    +0.075 A 
ATOM     14  C   LIG    1        1.343   0.192   1.318  0.00  0.00    +0.045 A 
ATOM     15  C   LIG    1        2.685   0.326   1.055  0.00  0.00    +0.108 A 
ENDBRANCH   1  13
TORSDOF 1