REMARK  Name = BDB002535
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.158  -0.135   1.285  0.00  0.00    +0.285 C 
ATOM      2  N   LIG    1        0.027  -0.205   0.527  0.00  0.00    -0.162 N 
ATOM      3  C   LIG    1        0.296  -0.785  -0.711  0.00  0.00    +0.219 A 
ATOM      4  N   LIG    1        1.575  -0.697  -0.972  0.00  0.00    -0.193 NA
ATOM      5  C   LIG    1        2.096  -0.033   0.111  0.00  0.00    +0.184 A 
ATOM      6  N   LIG    1        1.192   0.289   1.042  0.00  0.00    -0.141 NA
ATOM      7  O   LIG    1       -1.096   0.281   2.445  0.00  0.00    -0.265 OA
ENDROOT
BRANCH   1   9
ATOM      8  C   LIG    1       -3.135   0.102  -0.237  0.00  0.00    +0.132 A 
ATOM      9  C   LIG    1       -2.492  -0.557   0.821  0.00  0.00    +0.083 A 
ATOM     10  C   LIG    1       -3.146  -1.568   1.537  0.00  0.00    +0.017 A 
ATOM     11  C   LIG    1       -4.430  -1.959   1.167  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -5.063  -1.332   0.095  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1       -4.421  -0.305  -0.605  0.00  0.00    +0.046 A 
BRANCH   8  15
ATOM     14  C   LIG    1       -3.188   2.058  -1.582  0.00  0.00    +0.277 C 
ATOM     15  O   LIG    1       -2.425   1.080  -0.880  0.00  0.00    -0.494 OA
ENDBRANCH   8  15
ENDBRANCH   1   9
BRANCH   5  16
ATOM     16  C   LIG    1        3.519   0.284   0.217  0.00  0.00    +0.021 A 
ATOM     17  C   LIG    1        4.025   0.967   1.333  0.00  0.00    +0.011 A 
ATOM     18  C   LIG    1        5.386   1.267   1.428  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        6.257   0.887   0.408  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        5.769   0.208  -0.706  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        4.407  -0.092  -0.801  0.00  0.00    +0.011 A 
ENDBRANCH   5  16
BRANCH   3  22
ATOM     22  N   LIG    1       -0.599  -1.390  -1.527  0.00  0.00    -0.327 N 
ATOM     23  H   LIG    1       -0.174  -1.686  -2.405  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1       -1.443  -0.863  -1.739  0.00  0.00    +0.145 HD
ENDBRANCH   3  22
TORSDOF 4