REMARK  Name = BDB028267
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.696   1.274  -1.062  0.00  0.00    -0.014 A 
ATOM      2  C   LIG    1        1.495   0.246  -0.538  0.00  0.00    +0.019 A 
ATOM      3  C   LIG    1        2.764   0.536  -0.017  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1        3.228   1.849  -0.029  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1        4.562   2.144   0.519  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1        5.264   1.072   1.009  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1        6.187   1.256   1.391  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1        4.843  -0.221   1.032  0.00  0.00    -0.174 NA
ATOM      9  O   LIG    1        5.008   3.286   0.530  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1        2.441   2.878  -0.557  0.00  0.00    +0.014 A 
ATOM     11  C   LIG    1        3.663  -0.499   0.552  0.00  0.00    +0.083 A 
ATOM     12  C   LIG    1        1.177   2.588  -1.075  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  22
ATOM     13  C   LIG    1       -4.532  -2.113   2.186  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1       -3.192  -1.499   1.871  0.00  0.00    +0.213 C 
ATOM     15  N   LIG    1       -3.088  -0.749   0.705  0.00  0.00    -0.294 N 
ATOM     16  C   LIG    1       -1.807  -0.077   0.488  0.00  0.00    +0.163 C 
ATOM     17  C   LIG    1       -1.658   0.396  -0.915  0.00  0.00    +0.064 A 
ATOM     18  N   LIG    1       -2.692   0.344  -1.807  0.00  0.00    -0.265 N 
ATOM     19  N   LIG    1       -2.412   0.863  -3.012  0.00  0.00    -0.179 NA
ATOM     20  C   LIG    1       -1.143   1.260  -2.888  0.00  0.00    +0.143 A 
ATOM     21  C   LIG    1       -3.994  -0.223  -1.532  0.00  0.00    +0.163 C 
ATOM     22  C   LIG    1       -0.612   0.983  -1.606  0.00  0.00    +0.024 A 
ATOM     23  C   LIG    1       -4.245  -0.225  -0.032  0.00  0.00    +0.131 C 
ATOM     24  O   LIG    1       -2.235  -1.678   2.626  0.00  0.00    -0.276 OA
ENDBRANCH   1  22
BRANCH  11  25
ATOM     25  C   LIG    1        3.180  -1.954   0.572  0.00  0.00    +0.136 C 
BRANCH  25  26
ATOM     26  N   LIG    1        4.190  -2.837   1.167  0.00  0.00    -0.325 NA
ATOM     27  H   LIG    1        4.391  -2.485   2.107  0.00  0.00    +0.119 HD
ATOM     28  H   LIG    1        5.070  -2.677   0.670  0.00  0.00    +0.119 HD
ENDBRANCH  25  26
ENDBRANCH  11  25
TORSDOF 3