REMARK  Name = BDB059642
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.046  -0.794   0.449  0.00  0.00    +0.045 A 
ATOM      2  C   LIG    1       -3.494  -0.746   0.016  0.00  0.00    +0.279 A 
ATOM      3  O   LIG    1       -4.312  -1.631   0.228  0.00  0.00    -0.265 OA
ATOM      4  N   LIG    1       -3.868   0.422  -0.668  0.00  0.00    -0.179 N 
ATOM      5  C   LIG    1       -3.022   1.476  -0.941  0.00  0.00    +0.156 A 
ATOM      6  C   LIG    1       -3.763   2.412  -1.617  0.00  0.00    +0.114 A 
ATOM      7  C   LIG    1       -5.048   1.850  -1.712  0.00  0.00    +0.156 A 
ATOM      8  N   LIG    1       -1.742   1.386  -0.522  0.00  0.00    -0.338 N 
ATOM      9  H   LIG    1       -1.067   2.139  -0.664  0.00  0.00    +0.167 HD
ATOM     10  N   LIG    1       -5.127   0.644  -1.141  0.00  0.00    -0.169 NA
ATOM     11  C   LIG    1       -1.256   0.278   0.169  0.00  0.00    +0.060 A 
ENDROOT
BRANCH  11  12
ATOM     12  C   LIG    1        0.121   0.348   0.552  0.00  0.00    +0.037 A 
ATOM     13  C   LIG    1        1.197   0.394  -0.304  0.00  0.00    +0.124 A 
ATOM     14  N   LIG    1        2.333   0.472   0.479  0.00  0.00    -0.239 N 
ATOM     15  N   LIG    1        2.013   0.504   1.802  0.00  0.00    -0.174 NA
ATOM     16  C   LIG    1        0.682   0.434   1.836  0.00  0.00    +0.144 A 
BRANCH  14  17
ATOM     17  C   LIG    1        3.690   0.524   0.053  0.00  0.00    +0.065 A 
ATOM     18  C   LIG    1        4.710   0.611   1.014  0.00  0.00    +0.028 A 
ATOM     19  C   LIG    1        6.049   0.664   0.618  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        6.378   0.630  -0.735  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        5.372   0.543  -1.695  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        4.029   0.490  -1.307  0.00  0.00    +0.028 A 
ENDBRANCH  14  17
ENDBRANCH  11  12
BRANCH   1  24
ATOM     23  C   LIG    1       -2.262  -2.251   2.517  0.00  0.00    +0.012 C 
ATOM     24  C   LIG    1       -1.588  -2.066   1.154  0.00  0.00    +0.020 C 
ATOM     25  C   LIG    1       -1.741  -3.317   0.281  0.00  0.00    +0.012 C 
ENDBRANCH   1  24
BRANCH   6  26
ATOM     26  C   LIG    1       -3.322   3.669  -2.111  0.00  0.00    +0.104 C 
ATOM     27  N   LIG    1       -2.946   4.691  -2.510  0.00  0.00    -0.191 NA
ENDBRANCH   6  26
TORSDOF 4