REMARK  Name = BDB014066
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.341  -1.821   0.802  0.00  0.00    -0.292 NA
ATOM      2  C   LIG    1        1.804  -1.912  -0.567  0.00  0.00    +0.104 C 
ATOM      3  C   LIG    1        0.260  -1.875  -0.582  0.00  0.00    +0.123 C 
ATOM      4  N   LIG    1       -0.254  -0.662   0.094  0.00  0.00    -0.299 N 
ATOM      5  C   LIG    1        0.307  -0.521   1.460  0.00  0.00    +0.123 C 
ATOM      6  C   LIG    1        1.849  -0.585   1.440  0.00  0.00    +0.104 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -1.573  -0.285  -0.089  0.00  0.00    +0.200 A 
ATOM      8  N   LIG    1       -2.012  -0.199  -1.376  0.00  0.00    -0.295 N 
ATOM      9  H   LIG    1       -1.367  -0.327  -2.136  0.00  0.00    +0.172 HD
ATOM     10  C   LIG    1       -3.261   0.217  -1.707  0.00  0.00    +0.258 A 
ATOM     11  O   LIG    1       -3.614   0.345  -2.876  0.00  0.00    -0.267 OA
ATOM     12  C   LIG    1       -4.155   0.497  -0.572  0.00  0.00    +0.057 A 
ATOM     13  C   LIG    1       -5.560   0.919  -0.884  0.00  0.00    +0.045 C 
ATOM     14  C   LIG    1       -6.264   1.527   0.325  0.00  0.00    +0.024 C 
ATOM     15  C   LIG    1       -5.964   0.718   1.579  0.00  0.00    +0.106 C 
ATOM     16  N   LIG    1       -4.513   0.630   1.767  0.00  0.00    -0.318 N 
ATOM     17  C   LIG    1       -4.078   0.306   3.123  0.00  0.00    +0.130 C 
ATOM     18  C   LIG    1       -3.662   0.372   0.677  0.00  0.00    +0.133 A 
ATOM     19  N   LIG    1       -2.357  -0.000   0.903  0.00  0.00    -0.200 NA
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1        3.820  -1.921   0.836  0.00  0.00    +0.160 C 
BRANCH  20  25
ATOM     21  C   LIG    1        6.766   2.144  -1.928  0.00  0.00    +0.047 C 
ATOM     22  C   LIG    1        6.033   1.072  -1.200  0.00  0.00    -0.014 A 
ATOM     23  C   LIG    1        5.607  -0.085  -1.818  0.00  0.00    +0.117 A 
ATOM     24  N   LIG    1        4.912  -1.057  -1.196  0.00  0.00    -0.239 NA
ATOM     25  C   LIG    1        4.626  -0.852   0.108  0.00  0.00    +0.143 A 
ATOM     26  N   LIG    1        4.982   0.250   0.801  0.00  0.00    -0.239 NA
ATOM     27  C   LIG    1        5.673   1.188   0.125  0.00  0.00    +0.117 A 
ENDBRANCH  20  25
ENDBRANCH   1  20
TORSDOF 3