REMARK  Name = BDB048297
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.987  -1.359  -0.501  0.00  0.00    +0.128 A 
ATOM      2  C   LIG    1        0.191  -1.813   0.089  0.00  0.00    +0.047 A 
ATOM      3  C   LIG    1        1.297  -0.964   0.185  0.00  0.00    +0.015 A 
ATOM      4  C   LIG    1        1.242   0.344  -0.322  0.00  0.00    +0.023 A 
ATOM      5  C   LIG    1        0.056   0.780  -0.934  0.00  0.00    +0.015 A 
ATOM      6  C   LIG    1       -1.052  -0.069  -1.031  0.00  0.00    +0.047 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.402   1.223  -0.217  0.00  0.00    +0.202 A 
ATOM      8  N   LIG    1        3.587   0.813   0.363  0.00  0.00    -0.190 NA
ATOM      9  C   LIG    1        4.341   1.887   0.252  0.00  0.00    +0.248 A 
ATOM     10  O   LIG    1        3.712   2.930  -0.355  0.00  0.00    -0.336 OA
ATOM     11  N   LIG    1        2.427   2.491  -0.663  0.00  0.00    -0.056 NA
BRANCH   9  12
ATOM     12  C   LIG    1        5.751   2.110   0.688  0.00  0.00    +0.159 C 
ATOM     13  C   LIG    1        5.785   2.776   2.061  0.00  0.00    +0.038 C 
BRANCH  12  14
ATOM     14  N   LIG    1        6.430   0.820   0.716  0.00  0.00    -0.304 N 
ATOM     15  H   LIG    1        5.856  -0.006   0.844  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        7.796   0.719   0.678  0.00  0.00    +0.211 C 
ATOM     17  O   LIG    1        8.540   1.691   0.595  0.00  0.00    -0.276 OA
ATOM     18  C   LIG    1        8.322  -0.689   0.753  0.00  0.00    +0.109 C 
ENDBRANCH  12  14
ENDBRANCH   9  12
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  O   LIG    1       -2.025  -2.257  -0.594  0.00  0.00    -0.456 OA
BRANCH  19  23
ATOM     20  C   LIG    1       -5.909  -1.028   0.322  0.00  0.00    +0.121 A 
ATOM     21  C   LIG    1       -4.860  -0.705   1.189  0.00  0.00    +0.049 A 
ATOM     22  C   LIG    1       -3.550  -1.099   0.906  0.00  0.00    +0.050 A 
ATOM     23  C   LIG    1       -3.283  -1.807  -0.266  0.00  0.00    +0.129 A 
ATOM     24  C   LIG    1       -4.324  -2.149  -1.127  0.00  0.00    +0.050 A 
ATOM     25  C   LIG    1       -5.635  -1.752  -0.838  0.00  0.00    +0.049 A 
BRANCH  20  26
ATOM     26  O   LIG    1       -7.133  -0.573   0.725  0.00  0.00    -0.492 OA
BRANCH  26  28
ATOM     27  C   LIG    1       -8.567   0.033  -1.135  0.00  0.00    +0.048 C 
ATOM     28  C   LIG    1       -8.291  -0.956  -0.015  0.00  0.00    +0.225 C 
ENDBRANCH  26  28
ENDBRANCH  20  26
ENDBRANCH  19  23
ENDBRANCH   1  19
TORSDOF 7