REMARK  Name = BDB031237
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.909  -0.689   0.436  0.00  0.00    +0.076 C 
ATOM      2  C   LIG    1       -2.377  -0.608   1.874  0.00  0.00    +0.041 C 
ATOM      3  C   LIG    1       -1.216   0.369   1.997  0.00  0.00    +0.110 C 
ATOM      4  N   LIG    1       -0.112   0.014   1.110  0.00  0.00    -0.297 N 
ATOM      5  C   LIG    1        1.148   0.528   1.413  0.00  0.00    +0.247 C 
ATOM      6  O   LIG    1        1.347   1.331   2.323  0.00  0.00    -0.270 OA
ATOM      7  C   LIG    1       -0.453  -0.638  -0.159  0.00  0.00    +0.110 C 
ATOM      8  C   LIG    1       -1.862  -0.280  -0.610  0.00  0.00    +0.041 C 
ENDROOT
BRANCH   5   9
ATOM      9  C   LIG    1        2.316   0.095   0.613  0.00  0.00    +0.039 A 
ATOM     10  C   LIG    1        3.152   1.084   0.076  0.00  0.00    +0.041 A 
ATOM     11  C   LIG    1        4.237   0.640  -0.639  0.00  0.00    +0.068 A 
ATOM     12  C   LIG    1        4.512  -0.717  -0.815  0.00  0.00    +0.067 A 
ATOM     13  N   LIG    1        5.670  -0.824  -1.575  0.00  0.00    -0.306 N 
ATOM     14  H   LIG    1        6.137  -1.666  -1.868  0.00  0.00    +0.170 HD
ATOM     15  C   LIG    1        6.132   0.466  -1.878  0.00  0.00    +0.325 A 
ATOM     16  O   LIG    1        7.124   0.749  -2.525  0.00  0.00    -0.247 OA
ATOM     17  C   LIG    1        3.720  -1.706  -0.278  0.00  0.00    +0.028 A 
ATOM     18  N   LIG    1        5.229   1.364  -1.291  0.00  0.00    -0.306 N 
ATOM     19  H   LIG    1        5.323   2.365  -1.343  0.00  0.00    +0.170 HD
ATOM     20  C   LIG    1        2.605  -1.285   0.457  0.00  0.00    +0.015 A 
ENDBRANCH   5   9
BRANCH   1  23
ATOM     21  C   LIG    1       -6.156   0.840  -0.808  0.00  0.00    +0.109 C 
ATOM     22  C   LIG    1       -5.027  -0.151  -0.725  0.00  0.00    +0.210 C 
ATOM     23  N   LIG    1       -4.122   0.110   0.281  0.00  0.00    -0.313 N 
ATOM     24  H   LIG    1       -4.154   1.022   0.720  0.00  0.00    +0.149 HD
ATOM     25  O   LIG    1       -4.927  -1.095  -1.503  0.00  0.00    -0.276 OA
ENDBRANCH   1  23
TORSDOF 2