REMARK  Name = BDB024059
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.115   1.070   2.232  0.00  0.00    +0.052 C 
ATOM      2  C   LIG    1        0.685   0.199   1.306  0.00  0.00    +0.012 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1       -0.736  -0.048   1.030  0.00  0.00    -0.024 A 
ATOM      4  C   LIG    1       -1.674   0.988   0.973  0.00  0.00    +0.015 A 
ATOM      5  C   LIG    1       -3.024   0.733   0.676  0.00  0.00    -0.008 A 
ATOM      6  C   LIG    1       -3.987   1.885   0.680  0.00  0.00    +0.047 C 
ATOM      7  C   LIG    1       -3.417  -0.579   0.361  0.00  0.00    +0.128 A 
ATOM      8  C   LIG    1       -2.505  -1.640   0.477  0.00  0.00    -0.008 A 
ATOM      9  C   LIG    1       -2.899  -3.072   0.257  0.00  0.00    +0.047 C 
ATOM     10  C   LIG    1       -1.162  -1.355   0.778  0.00  0.00    +0.015 A 
BRANCH   7  11
ATOM     11  O   LIG    1       -4.720  -0.845   0.031  0.00  0.00    -0.475 OA
BRANCH  11  12
ATOM     12  C   LIG    1       -5.047  -0.711  -1.364  0.00  0.00    +0.200 C 
ATOM     13  C   LIG    1       -5.536  -2.089  -1.851  0.00  0.00    +0.067 C 
ATOM     14  C   LIG    1       -6.270   0.225  -1.435  0.00  0.00    +0.067 C 
BRANCH  12  15
ATOM     15  C   LIG    1       -3.984  -0.172  -2.360  0.00  0.00    +0.348 C 
ATOM     16  O   LIG    1       -3.887   0.974  -2.775  0.00  0.00    -0.247 OA
BRANCH  15  17
ATOM     17  O   LIG    1       -3.087  -1.098  -2.764  0.00  0.00    -0.478 OA
ATOM     18  H   LIG    1       -2.457  -0.587  -3.313  0.00  0.00    +0.295 HD
ENDBRANCH  15  17
ENDBRANCH  12  15
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   2   3
BRANCH   1  19
ATOM     19  C   LIG    1        2.544   1.324   2.557  0.00  0.00    +0.191 C 
ATOM     20  O   LIG    1        2.846   1.762   3.664  0.00  0.00    -0.287 OA
BRANCH  19  22
ATOM     21  C   LIG    1        3.611   1.468   0.282  0.00  0.00    +0.226 A 
ATOM     22  C   LIG    1        3.609   1.008   1.592  0.00  0.00    +0.084 A 
ATOM     23  C   LIG    1        4.694   0.247   2.028  0.00  0.00    +0.027 A 
ATOM     24  C   LIG    1        5.723  -0.067   1.133  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        5.623   0.416  -0.189  0.00  0.00    +0.075 A 
ATOM     26  C   LIG    1        6.640   0.100  -1.080  0.00  0.00    +0.028 A 
ATOM     27  C   LIG    1        7.740  -0.672  -0.695  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        7.836  -1.142   0.610  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        6.830  -0.841   1.525  0.00  0.00    +0.010 A 
ATOM     30  N   LIG    1        4.589   1.168  -0.607  0.00  0.00    -0.212 NA
BRANCH  21  32
ATOM     31  C   LIG    1        2.679   2.706  -1.482  0.00  0.00    +0.279 C 
ATOM     32  O   LIG    1        2.580   2.290  -0.124  0.00  0.00    -0.479 OA
ENDBRANCH  21  32
ENDBRANCH  19  22
ENDBRANCH   1  19
TORSDOF 8