REMARK  Name = BDB018211
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.986  -0.869  -0.700  0.00  0.00    -0.264 N 
ATOM      2  N   LIG    1       -0.480  -2.046  -0.270  0.00  0.00    -0.178 NA
ATOM      3  C   LIG    1        0.813  -1.781  -0.067  0.00  0.00    +0.143 A 
ATOM      4  C   LIG    1        1.152  -0.444  -0.369  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1       -0.036   0.119  -0.783  0.00  0.00    +0.117 A 
ENDROOT
BRANCH   4   6
ATOM      6  C   LIG    1        2.425   0.210  -0.268  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        3.362  -0.176   0.622  0.00  0.00    +0.097 A 
ATOM      8  N   LIG    1        4.596   0.449   0.732  0.00  0.00    -0.318 N 
ATOM      9  C   LIG    1        5.533  -0.037   1.733  0.00  0.00    +0.152 C 
ATOM     10  C   LIG    1        4.958   1.529  -0.068  0.00  0.00    +0.251 A 
ATOM     11  O   LIG    1        6.028   2.127  -0.012  0.00  0.00    -0.268 OA
ATOM     12  C   LIG    1        3.940   1.960  -1.058  0.00  0.00    +0.071 A 
ATOM     13  C   LIG    1        2.760   1.331  -1.137  0.00  0.00    +0.015 A 
ENDBRANCH   4   6
BRANCH   1  15
ATOM     14  C   LIG    1       -3.048  -2.025  -1.548  0.00  0.00    +0.038 C 
ATOM     15  C   LIG    1       -2.405  -0.728  -1.045  0.00  0.00    +0.134 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -3.185  -0.119   0.111  0.00  0.00    -0.023 A 
ATOM     17  C   LIG    1       -3.871   1.093  -0.063  0.00  0.00    +0.006 A 
ATOM     18  C   LIG    1       -4.596   1.658   0.988  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -4.646   1.018   2.225  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -3.973  -0.186   2.413  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -3.248  -0.753   1.363  0.00  0.00    +0.006 A 
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 3