REMARK  Name = BDB056484
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        1.320  -1.859  -1.223  0.00  0.00    -0.276 OA
ATOM      2  C   LIG    1        0.514  -0.928  -1.287  0.00  0.00    +0.216 C 
ATOM      3  N   LIG    1       -0.773  -1.034  -0.787  0.00  0.00    -0.298 N 
ATOM      4  C   LIG    1       -1.212  -2.323  -0.240  0.00  0.00    +0.126 C 
ATOM      5  C   LIG    1       -2.727  -2.522  -0.350  0.00  0.00    +0.127 C 
ATOM      6  N   LIG    1       -3.487  -1.433   0.269  0.00  0.00    -0.293 N 
ATOM      7  C   LIG    1       -4.836  -1.660   0.535  0.00  0.00    +0.263 C 
ATOM      8  O   LIG    1       -5.395  -2.671   0.109  0.00  0.00    -0.268 OA
ATOM      9  C   LIG    1       -2.838  -0.119   0.302  0.00  0.00    +0.127 C 
ATOM     10  C   LIG    1       -1.764   0.049  -0.786  0.00  0.00    +0.126 C 
ENDROOT
BRANCH   7  11
ATOM     11  C   LIG    1       -5.587  -0.688   1.309  0.00  0.00    +0.102 A 
ATOM     12  N   LIG    1       -6.962  -0.616   1.206  0.00  0.00    -0.357 N 
ATOM     13  H   LIG    1       -7.509  -1.218   0.603  0.00  0.00    +0.165 HD
ATOM     14  C   LIG    1       -7.454   0.364   2.024  0.00  0.00    +0.083 A 
ATOM     15  C   LIG    1       -6.395   0.905   2.714  0.00  0.00    +0.020 A 
ATOM     16  C   LIG    1       -5.226   0.229   2.284  0.00  0.00    +0.032 A 
ENDBRANCH   7  11
BRANCH   2  17
ATOM     17  C   LIG    1        0.908   0.405  -1.905  0.00  0.00    +0.103 C 
BRANCH  17  18
ATOM     18  C   LIG    1        2.271   0.345  -2.591  0.00  0.00    +0.083 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.392   0.516  -1.592  0.00  0.00    +0.111 A 
ATOM     20  N   LIG    1        3.682  -0.571  -0.814  0.00  0.00    -0.310 N 
ATOM     21  H   LIG    1        3.116  -1.416  -0.889  0.00  0.00    +0.170 HD
ATOM     22  C   LIG    1        4.643  -0.565   0.164  0.00  0.00    +0.259 A 
ATOM     23  O   LIG    1        4.856  -1.528   0.891  0.00  0.00    -0.267 OA
ATOM     24  C   LIG    1        5.399   0.692   0.296  0.00  0.00    +0.065 A 
ATOM     25  C   LIG    1        5.043   1.749  -0.546  0.00  0.00    +0.078 A 
ATOM     26  C   LIG    1        5.744   2.952  -0.438  0.00  0.00    +0.028 A 
ATOM     27  C   LIG    1        6.777   3.093   0.494  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        7.120   2.029   1.329  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        6.430   0.821   1.233  0.00  0.00    +0.015 A 
ATOM     30  N   LIG    1        4.009   1.648  -1.494  0.00  0.00    -0.234 NA
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   2  17
TORSDOF 4