REMARK  Name = BDB002982
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.673   0.662  -0.154  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1        4.247   0.199  -0.263  0.00  0.00    -0.028 A 
ATOM      3  C   LIG    1        3.909  -1.017  -0.871  0.00  0.00    +0.030 A 
ATOM      4  C   LIG    1        2.553  -1.335  -1.022  0.00  0.00    +0.053 A 
ATOM      5  C   LIG    1        1.541  -0.539  -0.500  0.00  0.00    +0.092 A 
ATOM      6  C   LIG    1        1.885   0.652   0.167  0.00  0.00    +0.090 A 
ATOM      7  N   LIG    1        0.943   1.456   0.693  0.00  0.00    -0.244 NA
ATOM      8  C   LIG    1       -0.341   1.078   0.552  0.00  0.00    +0.090 A 
ATOM      9  C   LIG    1       -0.691  -0.108  -0.116  0.00  0.00    +0.092 A 
ATOM     10  C   LIG    1       -2.038  -0.452  -0.234  0.00  0.00    +0.053 A 
ATOM     11  C   LIG    1       -3.086   0.324   0.294  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -2.698   1.505   0.939  0.00  0.00    +0.025 A 
ATOM     13  C   LIG    1       -1.351   1.869   1.067  0.00  0.00    +0.032 A 
ATOM     14  N   LIG    1        0.255  -0.913  -0.640  0.00  0.00    -0.244 NA
ATOM     15  C   LIG    1        3.224   1.003   0.268  0.00  0.00    +0.035 A 
ENDROOT
BRANCH   3  16
ATOM     16  N   LIG    1        4.869  -1.807  -1.518  0.00  0.00    -0.358 N 
ATOM     17  H   LIG    1        4.584  -2.771  -1.662  0.00  0.00    +0.142 HD
ATOM     18  H   LIG    1        5.802  -1.742  -1.124  0.00  0.00    +0.142 HD
ENDBRANCH   3  16
BRANCH  11  19
ATOM     19  N   LIG    1       -4.430  -0.035   0.148  0.00  0.00    -0.336 N 
ATOM     20  C   LIG    1       -4.765  -1.377  -0.329  0.00  0.00    +0.129 C 
ATOM     21  C   LIG    1       -5.432   0.598   1.005  0.00  0.00    +0.129 C 
ENDBRANCH  11  19
TORSDOF 2