REMARK  Name = BDB018287
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.080   2.389   0.307  0.00  0.00    +0.044 A 
ATOM      2  C   LIG    1        0.200   2.800  -0.336  0.00  0.00    +0.022 A 
ATOM      3  C   LIG    1        0.501   4.115  -0.405  0.00  0.00    +0.099 A 
ATOM      4  N   LIG    1       -0.299   5.104   0.131  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        0.140   6.486   0.042  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -1.443   4.800   0.847  0.00  0.00    +0.253 A 
ATOM      7  O   LIG    1       -2.160   5.621   1.413  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -1.808   3.365   0.892  0.00  0.00    +0.094 A 
ENDROOT
BRANCH   1  11
ATOM      9  C   LIG    1       -2.798  -0.923   0.836  0.00  0.00    +0.094 C 
ATOM     10  C   LIG    1       -2.584   0.541   1.217  0.00  0.00    +0.118 C 
ATOM     11  N   LIG    1       -1.542   1.055   0.305  0.00  0.00    -0.329 N 
ATOM     12  C   LIG    1       -1.186   0.009  -0.658  0.00  0.00    +0.106 C 
ATOM     13  C   LIG    1       -2.359  -0.964  -0.620  0.00  0.00    +0.033 C 
BRANCH   9  17
ATOM     14  C   LIG    1       -1.674  -4.285   2.177  0.00  0.00    +0.128 C 
ATOM     15  N   LIG    1       -2.208  -3.215   1.373  0.00  0.00    -0.318 N 
ATOM     16  H   LIG    1       -2.906  -3.447   0.678  0.00  0.00    +0.148 HD
ATOM     17  C   LIG    1       -2.029  -1.891   1.725  0.00  0.00    +0.217 C 
ATOM     18  O   LIG    1       -1.361  -1.549   2.695  0.00  0.00    -0.275 OA
ENDBRANCH   9  17
ENDBRANCH   1  11
BRANCH   2  19
ATOM     19  C   LIG    1        1.179   1.874  -0.818  0.00  0.00    +0.023 A 
ATOM     20  C   LIG    1        1.912   0.994  -0.055  0.00  0.00    +0.117 A 
ATOM     21  N   LIG    1        2.699   0.304  -0.934  0.00  0.00    -0.267 N 
ATOM     22  N   LIG    1        2.587   0.742  -2.210  0.00  0.00    -0.179 NA
ATOM     23  C   LIG    1        1.651   1.693  -2.134  0.00  0.00    +0.143 A 
BRANCH  21  24
ATOM     24  C   LIG    1        3.603  -0.790  -0.611  0.00  0.00    +0.178 C 
BRANCH  24  25
ATOM     25  C   LIG    1        2.871  -2.108  -0.561  0.00  0.00    -0.026 A 
ATOM     26  C   LIG    1        2.498  -2.758  -1.747  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1        1.813  -3.974  -1.705  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        1.494  -4.551  -0.478  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        1.853  -3.911   0.707  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        2.534  -2.693   0.668  0.00  0.00    +0.005 A 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH   2  19
TORSDOF 5