REMARK  Name = BDB022124
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.616   0.455  -0.580  0.00  0.00    +0.078 A 
ATOM      2  C   LIG    1       -0.604   1.069   0.143  0.00  0.00    +0.057 A 
ATOM      3  C   LIG    1       -0.699   2.148   1.162  0.00  0.00    +0.066 C 
ATOM      4  N   LIG    1        0.594   0.478  -0.266  0.00  0.00    -0.202 N 
ATOM      5  N   LIG    1        0.363  -0.479  -1.218  0.00  0.00    -0.171 NA
ATOM      6  C   LIG    1       -0.951  -0.451  -1.421  0.00  0.00    +0.148 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        1.940   0.755   0.188  0.00  0.00    +0.252 A 
ATOM      8  N   LIG    1        2.949   0.040  -0.352  0.00  0.00    -0.210 NA
ATOM      9  C   LIG    1        4.201   0.302   0.072  0.00  0.00    +0.083 A 
ATOM     10  C   LIG    1        4.473   1.265   1.020  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1        3.388   1.942   1.519  0.00  0.00    +0.117 A 
ATOM     12  N   LIG    1        2.124   1.710   1.127  0.00  0.00    -0.219 NA
BRANCH   9  13
ATOM     13  C   LIG    1        5.274  -0.489  -0.550  0.00  0.00    +0.038 A 
ATOM     14  S   LIG    1        4.971  -2.096  -1.087  0.00  0.00    -0.095 S 
ATOM     15  C   LIG    1        6.580  -2.305  -1.619  0.00  0.00    +0.046 A 
ATOM     16  C   LIG    1        7.346  -1.185  -1.398  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1        6.595  -0.141  -0.781  0.00  0.00    +0.017 A 
ENDBRANCH   9  13
ENDBRANCH   4   7
BRANCH   1  19
ATOM     18  N   LIG    1       -3.908  -0.246  -0.112  0.00  0.00    -0.298 N 
ATOM     19  C   LIG    1       -3.034   0.764  -0.528  0.00  0.00    +0.250 C 
ATOM     20  O   LIG    1       -3.427   1.888  -0.833  0.00  0.00    -0.270 OA
BRANCH  18  22
ATOM     21  C   LIG    1       -6.014  -0.314  -1.386  0.00  0.00    +0.024 C 
ATOM     22  C   LIG    1       -5.337   0.062  -0.078  0.00  0.00    +0.104 C 
ENDBRANCH  18  22
BRANCH  18  23
ATOM     23  C   LIG    1       -3.497  -1.539   0.445  0.00  0.00    +0.104 C 
ATOM     24  C   LIG    1       -3.217  -1.450   1.937  0.00  0.00    +0.024 C 
ENDBRANCH  18  23
ENDBRANCH   1  19
TORSDOF 5