REMARK  Name = BDB057192
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.827  -1.287   0.522  0.00  0.00    +0.099 A 
ATOM      2  C   LIG    1        1.346  -2.545   1.173  0.00  0.00    +0.270 A 
ATOM      3  O   LIG    1        0.573  -3.428   1.539  0.00  0.00    -0.266 OA
ATOM      4  N   LIG    1        2.706  -2.640   1.327  0.00  0.00    -0.327 N 
ATOM      5  H   LIG    1        3.045  -3.484   1.772  0.00  0.00    +0.168 HD
ATOM      6  C   LIG    1        3.590  -1.672   0.921  0.00  0.00    +0.094 A 
ATOM      7  C   LIG    1        3.157  -0.545   0.328  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1        1.724  -0.366   0.131  0.00  0.00    +0.038 A 
ENDROOT
BRANCH   7   9
ATOM      9  C   LIG    1        4.150   0.466  -0.080  0.00  0.00    -0.014 A 
ATOM     10  C   LIG    1        4.157   1.725   0.524  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1        5.104   2.647   0.111  0.00  0.00    +0.111 A 
ATOM     12  N   LIG    1        6.024   2.402  -0.847  0.00  0.00    -0.263 NA
ATOM     13  C   LIG    1        5.990   1.183  -1.424  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1        5.084   0.193  -1.081  0.00  0.00    +0.028 A 
ENDBRANCH   7   9
BRANCH   1  16
ATOM     15  C   LIG    1       -1.308  -0.182  -0.107  0.00  0.00    +0.248 C 
ATOM     16  N   LIG    1       -0.546  -1.220   0.386  0.00  0.00    -0.277 N 
ATOM     17  H   LIG    1       -1.021  -2.034   0.770  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -0.881   0.911  -0.463  0.00  0.00    -0.270 OA
BRANCH  15  21
ATOM     19  C   LIG    1       -5.022   0.485  -0.053  0.00  0.00    +0.121 A 
ATOM     20  C   LIG    1       -3.640   0.667  -0.010  0.00  0.00    +0.058 A 
ATOM     21  C   LIG    1       -2.778  -0.431  -0.159  0.00  0.00    +0.040 A 
ATOM     22  C   LIG    1       -3.306  -1.711  -0.379  0.00  0.00    +0.013 A 
ATOM     23  C   LIG    1       -4.688  -1.891  -0.419  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -5.538  -0.798  -0.252  0.00  0.00    +0.045 A 
BRANCH  19  26
ATOM     25  C   LIG    1       -5.493   2.799   0.232  0.00  0.00    +0.277 C 
ATOM     26  O   LIG    1       -5.967   1.465   0.085  0.00  0.00    -0.495 OA
ENDBRANCH  19  26
ENDBRANCH  15  21
ENDBRANCH   1  16
TORSDOF 4