REMARK  Name = BDB036859
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.248  -1.144  -0.243  0.00  0.00    +0.247 C 
ATOM      2  N   LIG    1       -0.422   0.077  -0.120  0.00  0.00    -0.289 N 
ATOM      3  C   LIG    1        0.208   1.369  -0.391  0.00  0.00    +0.133 C 
ATOM      4  O   LIG    1       -0.330  -2.226  -0.329  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.893   0.018  -0.089  0.00  0.00    +0.163 C 
ATOM      6  C   LIG    1       -2.510   0.139  -1.496  0.00  0.00    +0.240 C 
ATOM      7  O   LIG    1       -1.872   0.102  -2.545  0.00  0.00    -0.273 OA
ATOM      8  N   LIG    1       -3.876   0.318  -1.521  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -4.269   0.415  -2.448  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -4.625   0.886  -0.523  0.00  0.00    +0.219 C 
ATOM     11  O   LIG    1       -5.730   1.367  -0.755  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1       -4.028   0.867   0.865  0.00  0.00    +0.098 C 
ATOM     13  C   LIG    1       -2.522   1.077   0.818  0.00  0.00    +0.041 C 
ENDBRANCH   2   5
BRANCH   1  19
ATOM     14  C   LIG    1        4.633  -0.107   1.918  0.00  0.00    +0.065 C 
ATOM     15  C   LIG    1        3.820  -0.687   0.800  0.00  0.00    +0.039 A 
ATOM     16  N   LIG    1        4.492  -1.278  -0.215  0.00  0.00    -0.260 NA
ATOM     17  C   LIG    1        3.770  -1.830  -1.217  0.00  0.00    +0.112 A 
ATOM     18  C   LIG    1        2.391  -1.806  -1.269  0.00  0.00    +0.033 A 
ATOM     19  C   LIG    1        1.724  -1.166  -0.232  0.00  0.00    +0.040 A 
ATOM     20  C   LIG    1        2.434  -0.613   0.834  0.00  0.00    +0.036 A 
ENDBRANCH   1  19
TORSDOF 2