REMARK  Name = BDB011149
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.497   2.823  -1.290  0.00  0.00    -0.260 N 
ATOM      2  C   LIG    1        0.286   2.422  -0.725  0.00  0.00    +0.337 A 
ATOM      3  O   LIG    1       -0.702   3.160  -0.783  0.00  0.00    -0.246 OA
ATOM      4  N   LIG    1        0.258   1.131  -0.159  0.00  0.00    -0.261 N 
ATOM      5  C   LIG    1        1.443   0.318  -0.069  0.00  0.00    +0.074 A 
ATOM      6  C   LIG    1        2.515   0.675  -0.873  0.00  0.00    +0.082 A 
ATOM      7  C   LIG    1        3.600  -0.169  -0.964  0.00  0.00    +0.127 A 
ATOM      8  N   LIG    1        3.699  -1.317  -0.270  0.00  0.00    -0.250 NA
ATOM      9  C   LIG    1        2.748  -1.629   0.634  0.00  0.00    +0.114 A 
ATOM     10  C   LIG    1        2.913  -2.777   1.438  0.00  0.00    +0.146 A 
ATOM     11  C   LIG    1        1.996  -3.096   2.443  0.00  0.00    +0.048 A 
ATOM     12  C   LIG    1        0.916  -2.261   2.679  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1        0.733  -1.132   1.885  0.00  0.00    +0.012 A 
ATOM     14  C   LIG    1        1.602  -0.809   0.809  0.00  0.00    +0.029 A 
ATOM     15  C   LIG    1        2.529   1.949  -1.585  0.00  0.00    +0.266 A 
ATOM     16  O   LIG    1        3.438   2.188  -2.373  0.00  0.00    -0.267 OA
ENDROOT
BRANCH   4  17
ATOM     17  C   LIG    1       -1.029   0.509   0.014  0.00  0.00    +0.055 A 
ATOM     18  C   LIG    1       -2.063   1.181   0.682  0.00  0.00    +0.075 A 
ATOM     19  C   LIG    1       -3.324   0.592   0.842  0.00  0.00    +0.163 A 
ATOM     20  C   LIG    1       -3.564  -0.701   0.343  0.00  0.00    +0.162 A 
ATOM     21  C   LIG    1       -2.546  -1.367  -0.343  0.00  0.00    +0.051 A 
ATOM     22  C   LIG    1       -1.295  -0.764  -0.513  0.00  0.00    +0.030 A 
BRANCH  19  23
ATOM     23  O   LIG    1       -4.362   1.195   1.510  0.00  0.00    -0.491 OA
ATOM     24  C   LIG    1       -4.348   2.617   1.543  0.00  0.00    +0.277 C 
ENDBRANCH  19  23
BRANCH  20  25
ATOM     25  O   LIG    1       -4.818  -1.212   0.564  0.00  0.00    -0.491 OA
ATOM     26  C   LIG    1       -5.101  -2.508   0.056  0.00  0.00    +0.277 C 
ENDBRANCH  20  25
ENDBRANCH   4  17
BRANCH   1  28
ATOM     27  C   LIG    1        1.003   4.155  -3.327  0.00  0.00    +0.027 C 
ATOM     28  C   LIG    1        1.551   4.147  -1.905  0.00  0.00    +0.126 C 
ENDBRANCH   1  28
BRANCH  10  29
ATOM     29  O   LIG    1        4.032  -3.537   1.166  0.00  0.00    -0.493 OA
ATOM     30  C   LIG    1        4.276  -4.681   1.970  0.00  0.00    +0.277 C 
ENDBRANCH  10  29
TORSDOF 5