REMARK  Name = BDB001751
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.481  -0.834   0.247  0.00  0.00    +0.219 A 
ATOM      2  N   LIG    1        0.692   0.528   0.040  0.00  0.00    -0.160 N 
ATOM      3  C   LIG    1        1.884   1.288   0.025  0.00  0.00    +0.317 C 
ATOM      4  O   LIG    1        1.760   2.506   0.156  0.00  0.00    -0.262 OA
ATOM      5  N   LIG    1       -0.518   1.131  -0.168  0.00  0.00    -0.141 NA
ATOM      6  C   LIG    1       -1.370   0.101  -0.192  0.00  0.00    +0.185 A 
ATOM      7  N   LIG    1       -0.782  -1.115   0.051  0.00  0.00    -0.193 NA
ENDROOT
BRANCH   6   8
ATOM      8  C   LIG    1       -2.796   0.235  -0.438  0.00  0.00    +0.039 A 
ATOM      9  C   LIG    1       -3.385   1.477  -0.658  0.00  0.00    +0.122 A 
ATOM     10  N   LIG    1       -4.709   1.666  -0.894  0.00  0.00    -0.263 NA
ATOM     11  C   LIG    1       -5.485   0.562  -0.911  0.00  0.00    +0.111 A 
ATOM     12  C   LIG    1       -5.002  -0.719  -0.704  0.00  0.00    +0.020 A 
ATOM     13  C   LIG    1       -3.638  -0.881  -0.464  0.00  0.00    +0.014 A 
ENDBRANCH   6   8
BRANCH   3  14
ATOM     14  C   LIG    1        3.189   0.674  -0.141  0.00  0.00    +0.194 A 
ATOM     15  O   LIG    1        4.247   1.233   0.529  0.00  0.00    -0.458 OA
ATOM     16  C   LIG    1        5.357   0.523   0.208  0.00  0.00    +0.196 A 
ATOM     17  C   LIG    1        5.043  -0.487  -0.668  0.00  0.00    +0.042 A 
ATOM     18  C   LIG    1        3.650  -0.386  -0.902  0.00  0.00    +0.055 A 
ENDBRANCH   3  14
BRANCH   1  19
ATOM     19  N   LIG    1        1.404  -1.738   0.642  0.00  0.00    -0.327 N 
ATOM     20  H   LIG    1        2.144  -1.460   1.282  0.00  0.00    +0.145 HD
ATOM     21  H   LIG    1        1.006  -2.633   0.925  0.00  0.00    +0.145 HD
ENDBRANCH   1  19
TORSDOF 3