REMARK  Name = BDB064126
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.692  -0.543   0.213  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        1.672   0.408   0.079  0.00  0.00    +0.071 A 
ATOM      3  C   LIG    1        0.370  -0.069   0.210  0.00  0.00    +0.159 A 
ATOM      4  C   LIG    1        0.028  -1.385   0.454  0.00  0.00    +0.111 A 
ATOM      5  N   LIG    1       -1.335  -1.507   0.522  0.00  0.00    -0.195 NA
ATOM      6  C   LIG    1       -1.775  -0.281   0.322  0.00  0.00    +0.291 A 
ATOM      7  C   LIG    1        1.046  -2.333   0.585  0.00  0.00    +0.033 A 
ATOM      8  O   LIG    1       -0.785   0.648   0.123  0.00  0.00    -0.424 OA
ATOM      9  C   LIG    1        2.375  -1.893   0.460  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   6  10
ATOM     10  N   LIG    1       -3.049   0.162   0.297  0.00  0.00    -0.281 N 
ATOM     11  C   LIG    1       -4.145  -0.808   0.255  0.00  0.00    +0.137 C 
ATOM     12  C   LIG    1       -5.145  -0.421  -0.846  0.00  0.00    +0.179 C 
ATOM     13  O   LIG    1       -5.711   0.889  -0.686  0.00  0.00    -0.377 OA
ATOM     14  C   LIG    1       -4.851   1.804   0.012  0.00  0.00    +0.179 C 
ATOM     15  C   LIG    1       -3.355   1.513  -0.177  0.00  0.00    +0.137 C 
ENDBRANCH   6  10
BRANCH   1  17
ATOM     16  C   LIG    1        4.622   1.018  -0.084  0.00  0.00    +0.241 C 
ATOM     17  N   LIG    1        4.064  -0.227   0.103  0.00  0.00    -0.282 N 
ATOM     18  H   LIG    1        4.707  -0.998   0.222  0.00  0.00    +0.155 HD
ATOM     19  O   LIG    1        4.043   2.096  -0.127  0.00  0.00    -0.271 OA
BRANCH  16  21
ATOM     20  C   LIG    1        6.844   0.042  -0.736  0.00  0.00    +0.013 C 
ATOM     21  C   LIG    1        6.109   1.011  -0.174  0.00  0.00    +0.060 C 
ENDBRANCH  16  21
ENDBRANCH   1  17
TORSDOF 3