REMARK  Name = BDB024535
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.399  -1.121   0.016  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        4.236  -1.370   0.765  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        4.257  -2.564   1.638  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        5.181  -2.357   2.850  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        2.883  -3.009   2.162  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        1.821  -2.828   1.098  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        1.783  -1.369   0.747  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        0.570  -0.682   0.538  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1       -0.710  -1.156   0.615  0.00  0.00    -0.231 NA
ATOM     10  C   LIG    1       -1.512  -0.146   0.328  0.00  0.00    +0.118 A 
ATOM     11  N   LIG    1       -0.772   1.000   0.081  0.00  0.00    -0.324 N 
ATOM     12  C   LIG    1        0.570   0.666   0.209  0.00  0.00    +0.069 A 
ATOM     13  C   LIG    1        1.759   1.392   0.085  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        2.962   0.700   0.280  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        2.998  -0.668   0.585  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1        6.452  -1.734   0.175  0.00  0.00    -0.226 OA
ENDROOT
BRANCH  11  17
ATOM     17  C   LIG    1       -1.240   2.349  -0.228  0.00  0.00    +0.091 C 
ATOM     18  C   LIG    1       -2.064   2.479  -1.519  0.00  0.00    +0.040 C 
ATOM     19  C   LIG    1       -3.400   3.175  -1.283  0.00  0.00    +0.083 C 
ATOM     20  N   LIG    1       -3.276   4.447  -0.580  0.00  0.00    -0.316 NA
ATOM     21  H   LIG    1       -3.024   5.192  -1.231  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1       -2.352   4.445   0.552  0.00  0.00    +0.083 C 
ATOM     23  C   LIG    1       -1.877   3.057   0.974  0.00  0.00    +0.040 C 
ENDBRANCH  11  17
BRANCH   1  25
ATOM     24  C   LIG    1        6.410   0.014  -1.776  0.00  0.00    +0.282 C 
ATOM     25  O   LIG    1        5.252  -0.184  -0.965  0.00  0.00    -0.453 OA
ENDBRANCH   1  25
BRANCH  10  26
ATOM     26  C   LIG    1       -3.022  -0.271   0.289  0.00  0.00    +0.082 C 
ATOM     27  C   LIG    1       -3.514  -1.186   1.419  0.00  0.00    +0.020 C 
BRANCH  26  28
ATOM     28  C   LIG    1       -3.571  -0.768  -1.046  0.00  0.00    -0.037 A 
ATOM     29  C   LIG    1       -2.900  -1.726  -1.821  0.00  0.00    +0.004 A 
ATOM     30  C   LIG    1       -3.434  -2.167  -3.034  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -4.654  -1.668  -3.483  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -5.345  -0.734  -2.716  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       -4.812  -0.292  -1.504  0.00  0.00    +0.004 A 
ENDBRANCH  26  28
ENDBRANCH  10  26
TORSDOF 4