REMARK  Name = BDB001015
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.921   3.142  -1.113  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -1.433   2.083  -0.733  0.00  0.00    +0.257 A 
ATOM      3  C   LIG    1       -2.286   0.941  -0.277  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -1.678  -0.258   0.152  0.00  0.00    -0.007 A 
ATOM      5  C   LIG    1       -2.487  -1.317   0.576  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -3.879  -1.182   0.572  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -4.473   0.007   0.146  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -0.222  -0.336   0.133  0.00  0.00    -0.011 A 
ATOM      9  C   LIG    1        0.648  -1.494   0.538  0.00  0.00    +0.073 C 
ATOM     10  C   LIG    1        2.017  -0.921   0.278  0.00  0.00    -0.034 A 
ATOM     11  C   LIG    1        1.904   0.394  -0.211  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        3.030   1.134  -0.525  0.00  0.00    +0.010 A 
ATOM     13  C   LIG    1        4.283   0.539  -0.344  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1        4.392  -0.774   0.144  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1        3.253  -1.518   0.460  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1        0.491   0.719  -0.286  0.00  0.00    +0.054 A 
ATOM     17  C   LIG    1       -3.679   1.072  -0.279  0.00  0.00    +0.014 A 
ATOM     18  N   LIG    1       -0.068   1.883  -0.703  0.00  0.00    -0.321 N 
ATOM     19  H   LIG    1        0.509   2.653  -1.011  0.00  0.00    +0.169 HD
ENDROOT
TORSDOF 0