REMARK  Name = BDB036786
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.430   0.426  -0.141  0.00  0.00    +0.245 C 
ATOM      2  N   LIG    1       -0.586  -0.307   0.430  0.00  0.00    -0.300 N 
ATOM      3  H   LIG    1       -0.391  -0.842   1.272  0.00  0.00    +0.150 HD
ATOM      4  O   LIG    1        0.226   1.355  -0.913  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.981   0.068   0.234  0.00  0.00    +0.160 C 
ATOM      6  C   LIG    1       -2.827  -0.649   1.291  0.00  0.00    +0.240 C 
ATOM      7  O   LIG    1       -2.341  -1.149   2.305  0.00  0.00    -0.273 OA
ATOM      8  N   LIG    1       -4.178  -0.694   1.052  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -4.727  -1.184   1.747  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -4.783  -0.566  -0.172  0.00  0.00    +0.219 C 
ATOM     11  O   LIG    1       -5.942  -0.930  -0.343  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -3.961   0.069  -1.270  0.00  0.00    +0.098 C 
ATOM     13  C   LIG    1       -2.494  -0.311  -1.151  0.00  0.00    +0.041 C 
ENDBRANCH   2   5
BRANCH   1  19
ATOM     14  C   LIG    1        5.220   1.710   0.300  0.00  0.00    +0.065 C 
ATOM     15  C   LIG    1        4.121   0.702   0.452  0.00  0.00    +0.039 A 
ATOM     16  N   LIG    1        4.455  -0.514   0.943  0.00  0.00    -0.260 NA
ATOM     17  C   LIG    1        3.473  -1.432   1.070  0.00  0.00    +0.112 A 
ATOM     18  C   LIG    1        2.151  -1.197   0.740  0.00  0.00    +0.033 A 
ATOM     19  C   LIG    1        1.820   0.066   0.252  0.00  0.00    +0.040 A 
ATOM     20  C   LIG    1        2.820   1.028   0.093  0.00  0.00    +0.036 A 
ENDBRANCH   1  19
TORSDOF 2