REMARK  Name = BDB014833
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.197  -0.209   0.328  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -0.583  -0.547   1.199  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -5.207  -0.423   2.772  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -5.691  -0.512   1.346  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -4.731  -0.439   0.344  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -3.286  -0.573   0.627  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -2.472  -0.097  -0.522  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.068   0.073  -0.674  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -0.785   0.521  -1.902  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -1.971   0.652  -2.519  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -2.007   1.143  -3.875  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.012   0.270  -1.736  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.457   0.254  -2.062  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.175  -0.661  -1.049  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -6.894  -0.631   1.112  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        1.211  -0.110   0.403  0.00  0.00    +0.032 A 
ATOM     17  C   LIG    1        2.019   0.348  -0.639  0.00  0.00    +0.024 A 
ATOM     18  C   LIG    1        3.413   0.417  -0.505  0.00  0.00    +0.010 A 
ATOM     19  C   LIG    1        4.050   0.030   0.681  0.00  0.00    -0.018 A 
ATOM     20  C   LIG    1        3.243  -0.430   1.730  0.00  0.00    +0.010 A 
ATOM     21  C   LIG    1        1.850  -0.499   1.592  0.00  0.00    +0.024 A 
BRANCH  19  22
ATOM     22  C   LIG    1        5.513   0.101   0.820  0.00  0.00    -0.015 A 
ATOM     23  C   LIG    1        6.108   0.783   1.888  0.00  0.00    +0.028 A 
ATOM     24  C   LIG    1        7.491   0.822   1.975  0.00  0.00    +0.111 A 
ATOM     25  N   LIG    1        8.317   0.234   1.086  0.00  0.00    -0.263 NA
ATOM     26  C   LIG    1        7.731  -0.420   0.062  0.00  0.00    +0.111 A 
ATOM     27  C   LIG    1        6.359  -0.511  -0.112  0.00  0.00    +0.028 A 
ENDBRANCH  19  22
ENDBRANCH   1  16
TORSDOF 3