REMARK  Name = BDB018803
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.831  -0.959  -0.571  0.00  0.00    +0.241 C 
ATOM      2  N   LIG    1        0.458  -0.784  -0.580  0.00  0.00    -0.269 N 
ATOM      3  C   LIG    1       -0.437  -0.017   0.196  0.00  0.00    +0.040 A 
ATOM      4  C   LIG    1       -1.747  -0.189  -0.286  0.00  0.00    -0.021 A 
ATOM      5  C   LIG    1       -2.864   0.447   0.273  0.00  0.00    -0.039 A 
ATOM      6  C   LIG    1       -2.604   1.289   1.364  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1       -1.310   1.461   1.868  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1       -1.764  -1.082  -1.491  0.00  0.00    +0.056 C 
ATOM      9  C   LIG    1       -0.221   0.805   1.287  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -0.329  -1.590  -1.526  0.00  0.00    +0.118 C 
ATOM     11  O   LIG    1        2.344  -1.783  -1.341  0.00  0.00    -0.273 OA
ENDROOT
BRANCH   1  13
ATOM     12  N   LIG    1        4.141  -0.602   0.420  0.00  0.00    -0.258 N 
ATOM     13  C   LIG    1        2.723  -0.100   0.326  0.00  0.00    +0.170 C 
ATOM     14  C   LIG    1        2.864   1.310  -0.262  0.00  0.00    +0.034 C 
ATOM     15  C   LIG    1        4.276   1.728   0.102  0.00  0.00    +0.022 C 
ATOM     16  C   LIG    1        5.064   0.443  -0.067  0.00  0.00    +0.117 C 
BRANCH  12  18
ATOM     17  N   LIG    1        4.819  -2.876   1.188  0.00  0.00    -0.174 NA
ATOM     18  C   LIG    1        4.498  -1.830   0.809  0.00  0.00    +0.170 C 
ENDBRANCH  12  18
ENDBRANCH   1  13
BRANCH   5  19
ATOM     19  C   LIG    1       -4.258   0.281  -0.284  0.00  0.00    +0.019 C 
ATOM     20  C   LIG    1       -4.947  -1.061  -0.201  0.00  0.00    +0.009 C 
ATOM     21  C   LIG    1       -5.439   0.077   0.638  0.00  0.00    +0.009 C 
ENDBRANCH   5  19
TORSDOF 3