REMARK  Name = BDB024771
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.836  -3.304  -0.284  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        4.554  -1.935  -0.443  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        5.620  -1.048  -0.953  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        5.645  -1.043  -2.488  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        5.535   0.355  -0.360  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        4.197   0.983  -0.673  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        3.070   0.059  -0.314  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        1.782   0.604  -0.097  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1        1.375   1.916  -0.167  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1        0.090   1.922   0.125  0.00  0.00    +0.113 A 
ATOM     11  N   LIG    1       -0.351   0.641   0.377  0.00  0.00    -0.326 N 
ATOM     12  C   LIG    1        0.715  -0.217   0.234  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1        0.850  -1.596   0.352  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        2.125  -2.133   0.121  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        3.247  -1.349  -0.207  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1        4.092  -4.162   0.177  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1        6.445  -5.005  -0.568  0.00  0.00    +0.282 C 
ATOM     18  O   LIG    1        6.099  -3.626  -0.708  0.00  0.00    -0.453 OA
ENDBRANCH   1  18
BRANCH  11  19
ATOM     19  C   LIG    1       -1.704   0.247   0.738  0.00  0.00    +0.139 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.526  -0.151  -0.494  0.00  0.00    +0.106 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -3.938  -0.496  -0.270  0.00  0.00    -0.301 NA
ATOM     22  C   LIG    1       -4.762   0.662   0.061  0.00  0.00    +0.105 C 
BRANCH  21  23
ATOM     23  C   LIG    1       -4.155  -1.696   0.558  0.00  0.00    +0.061 C 
ATOM     24  C   LIG    1       -5.304  -2.524  -0.043  0.00  0.00    +0.047 C 
ATOM     25  C   LIG    1       -5.523  -3.791   0.773  0.00  0.00    +0.161 C 
ATOM     26  O   LIG    1       -5.776  -3.479   2.142  0.00  0.00    -0.380 OA
ATOM     27  C   LIG    1       -4.686  -2.792   2.751  0.00  0.00    +0.161 C 
ATOM     28  C   LIG    1       -4.435  -1.461   2.053  0.00  0.00    +0.047 C 
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  11  19
BRANCH  10  29
ATOM     29  C   LIG    1       -0.787   3.132   0.169  0.00  0.00    +0.097 C 
BRANCH  29  30
ATOM     30  C   LIG    1       -0.005   4.409  -0.112  0.00  0.00    +0.151 C 
BRANCH  30  31
ATOM     31  N   LIG    1       -0.881   5.563  -0.193  0.00  0.00    -0.271 N 
ATOM     32  N   LIG    1       -1.525   5.998   0.907  0.00  0.00    -0.180 NA
ATOM     33  C   LIG    1       -2.210   7.059   0.474  0.00  0.00    +0.134 A 
ATOM     34  C   LIG    1       -2.028   7.288  -0.902  0.00  0.00    +0.041 A 
ATOM     35  C   LIG    1       -1.163   6.300  -1.308  0.00  0.00    +0.108 A 
ENDBRANCH  30  31
ENDBRANCH  29  30
ENDBRANCH  10  29
TORSDOF 8