REMARK  Name = BDB018491
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.155  -0.445  -0.908  0.00  0.00    +0.022 A 
ATOM      2  C   LIG    1       -1.387   0.139  -1.105  0.00  0.00    +0.123 A 
ATOM      3  N   LIG    1       -2.104   0.002   0.071  0.00  0.00    -0.239 N 
ATOM      4  N   LIG    1       -1.365  -0.637   1.006  0.00  0.00    -0.174 NA
ATOM      5  C   LIG    1       -0.203  -0.915   0.412  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1        2.270  -0.088  -1.563  0.00  0.00    -0.003 A 
ATOM      7  C   LIG    1        0.903  -0.543  -1.869  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1        0.673  -1.063  -3.091  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1        1.662  -1.190  -4.051  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1        1.315  -1.783  -5.333  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1        2.973  -0.793  -3.821  0.00  0.00    +0.252 A 
ATOM     12  O   LIG    1        3.893  -0.887  -4.628  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1        3.242  -0.207  -2.486  0.00  0.00    +0.079 A 
BRANCH   6  18
ATOM     14  C   LIG    1        3.741   0.479   1.841  0.00  0.00    +0.215 A 
ATOM     15  N   LIG    1        3.389   1.749   2.132  0.00  0.00    -0.221 NA
ATOM     16  C   LIG    1        2.679   2.414   1.198  0.00  0.00    +0.115 A 
ATOM     17  C   LIG    1        2.297   1.865  -0.015  0.00  0.00    +0.028 A 
ATOM     18  C   LIG    1        2.670   0.549  -0.291  0.00  0.00    -0.011 A 
ATOM     19  C   LIG    1        3.412  -0.158   0.657  0.00  0.00    +0.075 A 
BRANCH  14  21
ATOM     20  C   LIG    1        4.742   0.441   3.955  0.00  0.00    +0.279 C 
ATOM     21  O   LIG    1        4.466  -0.265   2.750  0.00  0.00    -0.480 OA
ENDBRANCH  14  21
ENDBRANCH   6  18
ENDBRANCH   1   7
BRANCH   3  22
ATOM     22  C   LIG    1       -3.419   0.476   0.355  0.00  0.00    +0.077 A 
ATOM     23  C   LIG    1       -4.166   0.077   1.486  0.00  0.00    +0.063 A 
ATOM     24  C   LIG    1       -5.485   0.561   1.641  0.00  0.00    +0.015 A 
ATOM     25  C   LIG    1       -6.054   1.437   0.721  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1       -5.317   1.842  -0.381  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1       -4.017   1.366  -0.567  0.00  0.00    +0.028 A 
BRANCH  23  28
ATOM     28  C   LIG    1       -3.772  -0.867   2.574  0.00  0.00    +0.259 C 
ATOM     29  N   LIG    1       -2.585  -0.534   3.272  0.00  0.00    -0.219 N 
ATOM     30  H   LIG    1       -1.831  -0.194   2.659  0.00  0.00    +0.167 HD
ATOM     31  O   LIG    1       -4.538  -1.765   2.898  0.00  0.00    -0.269 OA
BRANCH  29  32
ATOM     32  C   LIG    1       -2.282  -1.419   4.222  0.00  0.00    +0.173 C 
ATOM     33  N   LIG    1       -1.956  -2.154   5.056  0.00  0.00    -0.174 NA
ENDBRANCH  29  32
ENDBRANCH  23  28
ENDBRANCH   3  22
TORSDOF 6