REMARK  Name = BDB020238
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.766  -0.043   0.272  0.00  0.00    +0.071 A 
ATOM      2  N   LIG    1       -0.456   0.749   1.347  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1        0.853   0.870   1.325  0.00  0.00    +0.204 A 
ATOM      4  N   LIG    1        1.438   0.183   0.282  0.00  0.00    -0.306 N 
ATOM      5  C   LIG    1        0.390  -0.414  -0.386  0.00  0.00    +0.116 A 
ENDROOT
BRANCH   1  12
ATOM      6  O   LIG    1       -6.235   0.370  -0.376  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -5.032   0.201  -0.198  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1       -4.103   0.833  -0.985  0.00  0.00    -0.256 N 
ATOM      9  H   LIG    1       -4.479   1.425  -1.712  0.00  0.00    +0.157 HD
ATOM     10  C   LIG    1       -2.764   0.534  -1.099  0.00  0.00    +0.228 C 
ATOM     11  O   LIG    1       -2.134   0.951  -2.071  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -2.183  -0.409  -0.048  0.00  0.00    +0.126 C 
ATOM     13  C   LIG    1       -3.069  -0.432   1.202  0.00  0.00    +0.028 C 
ATOM     14  C   LIG    1       -4.497  -0.777   0.818  0.00  0.00    +0.097 C 
ENDBRANCH   1  12
BRANCH   4  15
ATOM     15  C   LIG    1        2.827   0.102  -0.032  0.00  0.00    +0.047 A 
ATOM     16  C   LIG    1        3.780   0.752   0.767  0.00  0.00    +0.026 A 
ATOM     17  C   LIG    1        5.141   0.668   0.454  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1        5.563  -0.061  -0.654  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        4.626  -0.707  -1.454  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        3.264  -0.628  -1.148  0.00  0.00    +0.026 A 
ENDBRANCH   4  15
TORSDOF 2