REMARK  Name = BDB002923
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.278   0.840   2.294  0.00  0.00    +0.127 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.063   1.077   1.643  0.00  0.00    +0.168 C 
ATOM      3  O   LIG    1        1.595   2.186   1.646  0.00  0.00    -0.292 OA
BRANCH   2   6
ATOM      4  C   LIG    1        3.229  -0.821  -0.786  0.00  0.00    +0.121 A 
ATOM      5  C   LIG    1        2.579   0.217  -0.119  0.00  0.00    +0.057 A 
ATOM      6  C   LIG    1        1.744  -0.062   0.973  0.00  0.00    +0.021 A 
ATOM      7  C   LIG    1        1.573  -1.380   1.411  0.00  0.00    +0.011 A 
ATOM      8  C   LIG    1        2.229  -2.416   0.748  0.00  0.00    +0.004 A 
ATOM      9  C   LIG    1        3.050  -2.135  -0.345  0.00  0.00    +0.045 A 
BRANCH   4  11
ATOM     10  C   LIG    1        4.224   0.625  -2.389  0.00  0.00    +0.277 C 
ATOM     11  O   LIG    1        4.057  -0.689  -1.867  0.00  0.00    -0.495 OA
ENDBRANCH   4  11
ENDBRANCH   2   6
ENDBRANCH   1   2
BRANCH   1  12
ATOM     12  C   LIG    1       -1.173   2.044   2.144  0.00  0.00    +0.092 C 
ATOM     13  N   LIG    1       -2.050   2.260   1.207  0.00  0.00    -0.256 NA
BRANCH  13  14
ATOM     14  C   LIG    1       -2.240   1.284   0.213  0.00  0.00    +0.105 A 
ATOM     15  C   LIG    1       -1.435   1.267  -0.934  0.00  0.00    +0.142 A 
ATOM     16  C   LIG    1       -1.591   0.294  -1.912  0.00  0.00    +0.048 A 
ATOM     17  C   LIG    1       -2.585  -0.673  -1.761  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1       -3.418  -0.669  -0.632  0.00  0.00    -0.048 A 
ATOM     19  C   LIG    1       -4.522  -1.677  -0.501  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1       -3.249   0.327   0.342  0.00  0.00    +0.034 A 
BRANCH  15  21
ATOM     21  O   LIG    1       -0.467   2.218  -1.110  0.00  0.00    -0.505 OA
ATOM     22  H   LIG    1       -0.617   2.871  -0.397  0.00  0.00    +0.292 HD
ENDBRANCH  15  21
ENDBRANCH  13  14
ENDBRANCH   1  12
TORSDOF 6