REMARK  Name = BDB030250
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.407   0.710   1.534  0.00  0.00    +0.266 C 
ATOM      2  N   LIG    1        1.053   0.411   1.521  0.00  0.00    -0.296 N 
ATOM      3  C   LIG    1        0.377  -0.537   0.644  0.00  0.00    +0.112 C 
ATOM      4  C   LIG    1       -1.062  -0.454   1.042  0.00  0.00    +0.024 C 
ATOM      5  C   LIG    1       -1.849   0.832   0.874  0.00  0.00    +0.085 C 
ATOM      6  C   LIG    1       -1.181   0.481   2.191  0.00  0.00    +0.024 C 
ATOM      7  C   LIG    1        0.179   0.993   2.528  0.00  0.00    +0.112 C 
ATOM      8  O   LIG    1        2.867   1.503   2.358  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   1  11
ATOM      9  N   LIG    1        5.095  -0.504  -0.573  0.00  0.00    -0.334 N 
ATOM     10  C   LIG    1        4.656   0.280   0.455  0.00  0.00    +0.120 A 
ATOM     11  C   LIG    1        3.291   0.063   0.548  0.00  0.00    +0.143 A 
ATOM     12  N   LIG    1        2.913  -0.850  -0.426  0.00  0.00    -0.231 NA
ATOM     13  C   LIG    1        4.011  -1.166  -1.073  0.00  0.00    +0.200 A 
BRANCH   9  15
ATOM     14  C   LIG    1        6.986   0.701  -1.609  0.00  0.00    +0.030 C 
ATOM     15  C   LIG    1        6.463  -0.626  -1.061  0.00  0.00    +0.082 C 
ATOM     16  C   LIG    1        7.394  -1.193   0.010  0.00  0.00    +0.030 C 
ENDBRANCH   9  15
ENDBRANCH   1  11
BRANCH   5  17
ATOM     17  C   LIG    1       -3.335   0.788   0.777  0.00  0.00    +0.219 C 
ATOM     18  N   LIG    1       -3.896   0.282  -0.404  0.00  0.00    -0.299 N 
ATOM     19  C   LIG    1       -3.077   0.048  -1.592  0.00  0.00    +0.132 C 
ATOM     20  O   LIG    1       -3.979   1.190   1.738  0.00  0.00    -0.275 OA
BRANCH  18  21
ATOM     21  C   LIG    1       -5.388   0.140  -0.519  0.00  0.00    +0.029 C 
ATOM     22  C   LIG    1       -5.946  -0.734   0.626  0.00  0.00    +0.031 C 
ATOM     23  C   LIG    1       -6.059   1.528  -0.495  0.00  0.00    +0.031 C 
ATOM     24  C   LIG    1       -5.827  -0.555  -1.835  0.00  0.00    +0.031 C 
ENDBRANCH  18  21
ENDBRANCH   5  17
TORSDOF 4