REMARK  Name = BDB013248
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -2.466   3.947   0.449  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1       -1.710   2.982   0.441  0.00  0.00    +0.273 A 
ATOM      3  C   LIG    1       -1.977   1.811  -0.401  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1       -1.081   0.756  -0.354  0.00  0.00    +0.057 A 
ATOM      5  C   LIG    1       -1.255  -0.390  -1.131  0.00  0.00    +0.077 A 
ATOM      6  N   LIG    1       -0.357  -1.473  -1.109  0.00  0.00    -0.232 NA
ATOM      7  C   LIG    1        0.684  -1.380  -0.324  0.00  0.00    +0.126 A 
ATOM      8  N   LIG    1        0.928  -0.281   0.507  0.00  0.00    -0.310 N 
ATOM      9  C   LIG    1        2.200  -0.189   1.240  0.00  0.00    +0.140 C 
ATOM     10  C   LIG    1        2.852  -1.557   1.456  0.00  0.00    +0.103 C 
ATOM     11  N   LIG    1        2.960  -2.287   0.193  0.00  0.00    -0.308 NA
ATOM     12  H   LIG    1        3.466  -3.160   0.339  0.00  0.00    +0.122 HD
ATOM     13  C   LIG    1        1.614  -2.603  -0.305  0.00  0.00    +0.156 C 
ATOM     14  C   LIG    1       -2.374  -0.456  -1.966  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1       -3.290   0.601  -2.020  0.00  0.00    +0.003 A 
ATOM     16  C   LIG    1        0.095   0.836   0.527  0.00  0.00    +0.165 A 
ATOM     17  N   LIG    1        0.319   1.890   1.264  0.00  0.00    -0.152 NA
ATOM     18  C   LIG    1       -3.093   1.740  -1.236  0.00  0.00    +0.014 A 
ATOM     19  N   LIG    1       -0.569   2.926   1.209  0.00  0.00    -0.241 N 
ATOM     20  H   LIG    1       -0.365   3.729   1.796  0.00  0.00    +0.192 HD
ENDROOT
TORSDOF 0