REMARK  Name = BDB016313
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.861   0.844  -0.283  0.00  0.00    +0.068 A 
ATOM      2  C   LIG    1        0.590   0.218  -0.275  0.00  0.00    +0.157 A 
ATOM      3  O   LIG    1       -0.418   1.026  -0.716  0.00  0.00    -0.486 OA
ATOM      4  C   LIG    1       -1.768   0.775  -0.354  0.00  0.00    +0.179 C 
ATOM      5  C   LIG    1       -2.284  -0.483  -1.009  0.00  0.00    +0.140 C 
ATOM      6  C   LIG    1       -1.923  -1.722  -0.259  0.00  0.00    +0.221 C 
ATOM      7  N   LIG    1       -0.661  -1.918   0.192  0.00  0.00    -0.282 N 
ATOM      8  H   LIG    1       -0.568  -2.839   0.606  0.00  0.00    +0.155 HD
ATOM      9  O   LIG    1       -2.754  -2.617  -0.086  0.00  0.00    -0.275 OA
ATOM     10  C   LIG    1       -2.037   0.936   1.141  0.00  0.00    +0.052 C 
ATOM     11  C   LIG    1        0.492  -1.113   0.159  0.00  0.00    +0.077 A 
ATOM     12  C   LIG    1        1.654  -1.764   0.620  0.00  0.00    +0.027 A 
ATOM     13  C   LIG    1        2.897  -1.133   0.625  0.00  0.00    +0.003 A 
ATOM     14  C   LIG    1        3.001   0.171   0.165  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  16
ATOM     15  C   LIG    1        2.164   3.330  -1.115  0.00  0.00    +0.009 C 
ATOM     16  C   LIG    1        2.024   2.199  -0.737  0.00  0.00    -0.066 C 
ENDBRANCH   1  16
TORSDOF 1