REMARK  Name = BDB028106
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.475  -0.352   2.749  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1        1.153   0.141   1.623  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1        2.293  -0.525   1.216  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1        3.192  -0.225   0.094  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1        4.141  -1.238   0.058  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        4.039  -2.117   1.214  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1        3.100   0.747  -0.627  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.783  -1.653   1.873  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1        2.123  -2.160   2.977  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1        0.962  -1.507   3.411  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        5.349  -1.199  -0.758  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        6.386  -0.223  -0.181  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        6.504   0.010   1.021  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        7.287   0.302  -1.079  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        7.994   0.908  -0.691  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        7.427  -0.007  -2.408  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        8.392   0.398  -3.051  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        6.397  -0.941  -3.002  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        5.087  -0.892  -2.233  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1       -0.778   0.335   3.228  0.00  0.00    +0.141 C 
BRANCH  20  24
ATOM     21  N   LIG    1       -3.680   0.096   1.041  0.00  0.00    -0.269 N 
ATOM     22  H   LIG    1       -3.686  -0.907   1.133  0.00  0.00    +0.156 HD
ATOM     23  C   LIG    1       -2.633   0.749   1.653  0.00  0.00    +0.304 C 
ATOM     24  N   LIG    1       -1.922  -0.106   2.466  0.00  0.00    -0.295 N 
ATOM     25  H   LIG    1       -2.236  -1.051   2.594  0.00  0.00    +0.151 HD
ATOM     26  O   LIG    1       -2.333   1.927   1.526  0.00  0.00    -0.252 OA
BRANCH  21  30
ATOM     27  C   LIG    1       -7.636  -0.737  -1.767  0.00  0.00    +0.044 C 
ATOM     28  C   LIG    1       -6.628   0.215  -1.194  0.00  0.00    -0.048 A 
ATOM     29  C   LIG    1       -5.597  -0.244  -0.362  0.00  0.00    +0.026 A 
ATOM     30  C   LIG    1       -4.676   0.644   0.208  0.00  0.00    +0.035 A 
ATOM     31  C   LIG    1       -4.803   2.006  -0.059  0.00  0.00    +0.026 A 
ATOM     32  C   LIG    1       -5.839   2.489  -0.875  0.00  0.00    -0.048 A 
ATOM     33  C   LIG    1       -5.944   3.958  -1.164  0.00  0.00    +0.044 C 
ATOM     34  C   LIG    1       -6.742   1.587  -1.445  0.00  0.00    +0.006 A 
ENDBRANCH  21  30
ENDBRANCH  20  24
ENDBRANCH   1  20
TORSDOF 4