REMARK  Name = BDB013056
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.519   0.192  -0.157  0.00  0.00    +0.048 A 
ATOM      2  C   LIG    1        1.909  -1.076  -0.361  0.00  0.00    +0.173 A 
ATOM      3  N   LIG    1        0.556  -1.172  -0.139  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1        0.240  -2.478  -0.378  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        1.317  -3.138  -0.741  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1       -0.238  -0.090   0.259  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1        0.330   1.070   0.456  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1        2.372  -2.252  -0.732  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        1.692   1.179   0.255  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        6.629   0.921  -0.648  0.00  0.00    +0.318 A 
ATOM     11  N   LIG    1        6.266  -0.251  -0.105  0.00  0.00    -0.203 NA
ATOM     12  C   LIG    1        4.936  -0.456   0.032  0.00  0.00    +0.126 A 
ATOM     13  C   LIG    1        3.962   0.460  -0.327  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1        4.470   1.619  -0.887  0.00  0.00    +0.126 A 
ATOM     15  N   LIG    1        5.784   1.880  -1.051  0.00  0.00    -0.203 NA
BRANCH  10  17
ATOM     16  C   LIG    1        8.822   0.155  -0.439  0.00  0.00    +0.280 C 
ATOM     17  O   LIG    1        7.962   1.218  -0.824  0.00  0.00    -0.466 OA
ENDBRANCH  10  17
ENDBRANCH   1  13
BRANCH   6  18
ATOM     18  N   LIG    1       -1.590  -0.277   0.433  0.00  0.00    -0.310 N 
ATOM     19  H   LIG    1       -2.043  -1.084   0.019  0.00  0.00    +0.149 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.485   0.833   0.700  0.00  0.00    +0.140 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -3.895   0.314   0.792  0.00  0.00    -0.024 A 
ATOM     22  C   LIG    1       -4.731   0.237  -0.317  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -4.481   0.592  -1.735  0.00  0.00    +0.080 C 
ATOM     24  C   LIG    1       -5.913   0.521  -2.266  0.00  0.00    +0.234 C 
ATOM     25  O   LIG    1       -6.693  -0.333  -1.401  0.00  0.00    -0.491 OA
ATOM     26  C   LIG    1       -6.005  -0.307  -0.215  0.00  0.00    +0.124 A 
ATOM     27  C   LIG    1       -6.502  -0.798   0.973  0.00  0.00    +0.046 A 
ATOM     28  C   LIG    1       -5.685  -0.727   2.101  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -4.394  -0.181   2.011  0.00  0.00    +0.005 A 
ENDBRANCH  20  21
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 5