REMARK  Name = BDB020808
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.619  -0.041  -0.210  0.00  0.00    +0.041 A 
ATOM      2  C   LIG    1        0.164  -1.101   0.347  0.00  0.00    +0.172 A 
ATOM      3  N   LIG    1        1.520  -1.064   0.135  0.00  0.00    -0.253 N 
ATOM      4  C   LIG    1        2.014  -2.205   0.696  0.00  0.00    +0.232 A 
ATOM      5  N   LIG    1        1.043  -2.870   1.279  0.00  0.00    -0.137 NA
ATOM      6  C   LIG    1        2.162  -0.035  -0.554  0.00  0.00    +0.203 A 
ATOM      7  N   LIG    1        1.455   0.929  -1.077  0.00  0.00    -0.223 NA
ATOM      8  N   LIG    1       -0.125  -2.171   1.064  0.00  0.00    -0.129 NA
ATOM      9  C   LIG    1        0.087   0.897  -0.887  0.00  0.00    +0.126 A 
ENDROOT
BRANCH   1  15
ATOM     10  C   LIG    1       -7.141  -0.545  -0.489  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1       -6.275   0.609  -0.047  0.00  0.00    +0.213 C 
ATOM     12  N   LIG    1       -4.917   0.356   0.109  0.00  0.00    -0.298 N 
ATOM     13  C   LIG    1       -4.085   1.410   0.680  0.00  0.00    +0.113 C 
ATOM     14  C   LIG    1       -2.701   1.444   0.030  0.00  0.00    +0.054 C 
ATOM     15  C   LIG    1       -2.082   0.067  -0.069  0.00  0.00    -0.036 C 
ATOM     16  C   LIG    1       -2.881  -1.016   0.011  0.00  0.00    -0.004 C 
ATOM     17  C   LIG    1       -4.373  -0.996   0.160  0.00  0.00    +0.135 C 
ATOM     18  O   LIG    1       -6.777   1.717   0.143  0.00  0.00    -0.276 OA
ENDBRANCH   1  15
BRANCH   6  19
ATOM     19  N   LIG    1        3.530  -0.041  -0.705  0.00  0.00    -0.307 N 
ATOM     20  H   LIG    1        3.768   0.634  -1.435  0.00  0.00    +0.149 HD
BRANCH  19  21
ATOM     21  C   LIG    1        4.367   0.301   0.448  0.00  0.00    +0.178 C 
BRANCH  21  22
ATOM     22  C   LIG    1        5.814   0.380   0.113  0.00  0.00    +0.122 A 
ATOM     23  O   LIG    1        6.188   1.405  -0.708  0.00  0.00    -0.466 OA
ATOM     24  C   LIG    1        7.528   1.295  -0.893  0.00  0.00    +0.195 A 
ATOM     25  C   LIG    1        8.023   0.212  -0.205  0.00  0.00    +0.041 A 
ATOM     26  C   LIG    1        6.914  -0.383   0.446  0.00  0.00    +0.046 A 
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   6  19
TORSDOF 4