REMARK  Name = BDB005650
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.632   0.662   0.784  0.00  0.00    +0.132 A 
ATOM      2  C   LIG    1       -0.179  -0.410   0.358  0.00  0.00    +0.061 A 
ATOM      3  C   LIG    1        0.092  -1.680   0.900  0.00  0.00    +0.055 A 
ATOM      4  N   LIG    1       -0.677  -2.785   0.522  0.00  0.00    -0.322 N 
ATOM      5  H   LIG    1       -0.499  -3.697   0.917  0.00  0.00    +0.169 HD
ATOM      6  C   LIG    1       -1.714  -2.724  -0.362  0.00  0.00    +0.254 A 
ATOM      7  C   LIG    1       -2.007  -1.398  -0.961  0.00  0.00    +0.038 A 
ATOM      8  C   LIG    1       -3.144  -1.335  -1.949  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1       -3.174  -0.029  -2.752  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1       -2.856   1.167  -1.861  0.00  0.00    +0.102 C 
ATOM     11  N   LIG    1       -1.587   0.926  -1.197  0.00  0.00    -0.343 N 
ATOM     12  H   LIG    1       -1.214   1.710  -0.657  0.00  0.00    +0.146 HD
ATOM     13  O   LIG    1       -2.370  -3.725  -0.640  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1        1.121  -1.882   1.829  0.00  0.00    +0.031 A 
ATOM     15  C   LIG    1        1.902  -0.807   2.263  0.00  0.00    -0.028 A 
ATOM     16  C   LIG    1       -1.290  -0.306  -0.628  0.00  0.00    +0.048 A 
ATOM     17  C   LIG    1        1.646   0.465   1.736  0.00  0.00    +0.051 A 
ENDROOT
BRANCH   1  18
ATOM     18  O   LIG    1        0.374   1.932   0.318  0.00  0.00    -0.492 OA
BRANCH  18  20
ATOM     19  C   LIG    1        1.077   3.585  -1.253  0.00  0.00    +0.048 C 
ATOM     20  C   LIG    1        1.535   2.590  -0.204  0.00  0.00    +0.226 C 
ENDBRANCH  18  20
ENDBRANCH   1  18
BRANCH  15  21
ATOM     21  C   LIG    1        3.018  -1.019   3.252  0.00  0.00    +0.113 C 
BRANCH  21  22
ATOM     22  N   LIG    1        4.273  -1.318   2.575  0.00  0.00    -0.326 NA
ATOM     23  H   LIG    1        4.503  -0.553   1.944  0.00  0.00    +0.119 HD
ATOM     24  H   LIG    1        4.145  -2.135   1.980  0.00  0.00    +0.119 HD
ENDBRANCH  21  22
ENDBRANCH  15  21
TORSDOF 4