REMARK  Name = BDB065238
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.684   0.930  -0.343  0.00  0.00    +0.164 A 
ATOM      2  C   LIG    1        2.771   0.873  -1.407  0.00  0.00    +0.162 A 
ATOM      3  C   LIG    1        1.432   0.584  -1.138  0.00  0.00    +0.062 A 
ATOM      4  C   LIG    1        0.986   0.347   0.187  0.00  0.00    +0.044 A 
ATOM      5  C   LIG    1        1.910   0.385   1.239  0.00  0.00    +0.081 A 
ATOM      6  N   LIG    1        1.568   0.146   2.507  0.00  0.00    -0.218 NA
ATOM      7  C   LIG    1        0.279  -0.147   2.737  0.00  0.00    +0.234 A 
ATOM      8  N   LIG    1       -0.695  -0.202   1.818  0.00  0.00    -0.203 NA
ATOM      9  C   LIG    1       -0.345   0.057   0.550  0.00  0.00    +0.131 A 
ATOM     10  C   LIG    1        3.238   0.680   0.960  0.00  0.00    +0.078 A 
ENDROOT
BRANCH   1  12
ATOM     11  C   LIG    1        5.938   1.290   0.373  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1        4.982   1.227  -0.676  0.00  0.00    -0.491 OA
ENDBRANCH   1  12
BRANCH   2  13
ATOM     13  O   LIG    1        3.278   1.119  -2.657  0.00  0.00    -0.491 OA
ATOM     14  C   LIG    1        2.413   0.947  -3.771  0.00  0.00    +0.277 C 
ENDBRANCH   2  13
BRANCH   7  15
ATOM     15  C   LIG    1       -0.096  -0.420   4.100  0.00  0.00    +0.140 C 
ATOM     16  N   LIG    1       -0.397  -0.638   5.203  0.00  0.00    -0.188 NA
ENDBRANCH   7  15
BRANCH   9  17
ATOM     17  N   LIG    1       -1.339   0.025  -0.454  0.00  0.00    -0.325 N 
ATOM     18  H   LIG    1       -1.326   0.929  -0.923  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -2.704  -0.340  -0.035  0.00  0.00    +0.076 C 
ATOM     20  C   LIG    1       -2.804  -1.847   0.253  0.00  0.00    +0.050 C 
ATOM     21  C   LIG    1       -4.165  -2.417  -0.126  0.00  0.00    +0.161 C 
ATOM     22  O   LIG    1       -5.181  -1.449   0.112  0.00  0.00    -0.380 OA
ATOM     23  C   LIG    1       -5.105  -0.342  -0.786  0.00  0.00    +0.161 C 
ATOM     24  C   LIG    1       -3.675   0.039  -1.156  0.00  0.00    +0.050 C 
ENDBRANCH  17  19
ENDBRANCH   9  17
TORSDOF 5