REMARK  Name = BDB063355
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.098  -1.298  -0.274  0.00  0.00    +0.062 A 
ATOM      2  C   LIG    1        0.002  -0.401  -1.370  0.00  0.00    +0.174 A 
ATOM      3  N   LIG    1        1.169   0.311  -1.489  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1        0.994   1.115  -2.578  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1       -0.191   0.901  -3.105  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        2.248   0.181  -0.603  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1        2.149  -0.648   0.402  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1       -0.820  -0.059  -2.343  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        0.980  -1.372   0.537  0.00  0.00    +0.128 A 
ENDROOT
BRANCH   1  19
ATOM     10  C   LIG    1       -2.918  -0.295   0.441  0.00  0.00    +0.421 C 
ATOM     11  N   LIG    1       -2.510  -1.638   0.213  0.00  0.00    -0.245 N 
ATOM     12  C   LIG    1       -3.389  -2.741   0.224  0.00  0.00    +0.060 A 
ATOM     13  C   LIG    1       -2.628  -3.910   0.137  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -3.270  -5.165   0.165  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -4.660  -5.230   0.280  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -5.410  -4.065   0.366  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1       -1.277  -3.524   0.011  0.00  0.00    +0.037 A 
ATOM     18  C   LIG    1       -4.793  -2.810   0.343  0.00  0.00    +0.027 A 
ATOM     19  C   LIG    1       -1.216  -2.144  -0.011  0.00  0.00    +0.066 A 
ATOM     20  O   LIG    1       -4.096   0.029   0.424  0.00  0.00    -0.223 OA
BRANCH  10  21
ATOM     21  O   LIG    1       -1.859   0.491   0.755  0.00  0.00    -0.442 OA
BRANCH  21  23
ATOM     22  C   LIG    1       -2.913   2.069   2.325  0.00  0.00    +0.055 C 
ATOM     23  C   LIG    1       -2.054   1.894   1.067  0.00  0.00    +0.107 C 
ATOM     24  C   LIG    1       -2.630   2.656  -0.131  0.00  0.00    +0.055 C 
ATOM     25  C   LIG    1       -0.646   2.433   1.362  0.00  0.00    +0.055 C 
ENDBRANCH  21  23
ENDBRANCH  10  21
ENDBRANCH   1  19
BRANCH   6  26
ATOM     26  N   LIG    1        3.379   0.936  -0.815  0.00  0.00    -0.307 N 
ATOM     27  H   LIG    1        3.575   1.269  -1.754  0.00  0.00    +0.149 HD
BRANCH  26  28
ATOM     28  C   LIG    1        4.605   0.682  -0.074  0.00  0.00    +0.178 C 
BRANCH  28  29
ATOM     29  C   LIG    1        5.724   1.581  -0.475  0.00  0.00    +0.122 A 
ATOM     30  O   LIG    1        5.902   1.769  -1.818  0.00  0.00    -0.466 OA
ATOM     31  C   LIG    1        6.959   2.609  -1.963  0.00  0.00    +0.195 A 
ATOM     32  C   LIG    1        7.462   2.967  -0.735  0.00  0.00    +0.041 A 
ATOM     33  C   LIG    1        6.665   2.303   0.229  0.00  0.00    +0.046 A 
ENDBRANCH  28  29
ENDBRANCH  26  28
ENDBRANCH   6  26
TORSDOF 6