REMARK  Name = BDB062156
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.122  -2.071   0.684  0.00  0.00    +0.097 A 
ATOM      2  C   LIG    1       -3.427  -1.701   0.381  0.00  0.00    +0.077 A 
ATOM      3  N   LIG    1       -4.166  -2.815   0.725  0.00  0.00    -0.333 N 
ATOM      4  C   LIG    1       -5.583  -3.014   0.535  0.00  0.00    +0.150 C 
ATOM      5  C   LIG    1       -3.316  -3.746   1.252  0.00  0.00    +0.200 A 
ATOM      6  N   LIG    1       -2.073  -3.329   1.235  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   2   7
ATOM      7  C   LIG    1       -3.978  -0.489  -0.234  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1       -4.781   0.440   0.489  0.00  0.00    -0.007 A 
ATOM      9  C   LIG    1       -5.307   1.576  -0.186  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1       -6.113   2.484   0.545  0.00  0.00    +0.010 A 
ATOM     11  C   LIG    1       -6.391   2.299   1.899  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -5.866   1.203   2.563  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -5.003   1.760  -1.560  0.00  0.00    +0.059 A 
ATOM     14  C   LIG    1       -4.199   0.844  -2.247  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1       -5.073   0.291   1.868  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1       -3.693  -0.271  -1.589  0.00  0.00    +0.012 A 
BRANCH  13  17
ATOM     17  C   LIG    1       -5.500   2.889  -2.298  0.00  0.00    +0.100 C 
ATOM     18  N   LIG    1       -5.903   3.796  -2.899  0.00  0.00    -0.191 NA
ENDBRANCH  13  17
ENDBRANCH   2   7
BRANCH   1  21
ATOM     19  C   LIG    1       -0.370  -2.848  -1.521  0.00  0.00    +0.044 C 
ATOM     20  C   LIG    1       -0.095  -1.635  -0.670  0.00  0.00    -0.041 A 
ATOM     21  C   LIG    1       -0.927  -1.284   0.419  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1       -0.585  -0.183   1.234  0.00  0.00    -0.041 A 
ATOM     23  C   LIG    1       -1.400   0.232   2.429  0.00  0.00    +0.044 C 
ATOM     24  C   LIG    1        0.547   0.587   0.912  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        1.366   0.260  -0.174  0.00  0.00    -0.033 A 
ATOM     26  C   LIG    1        1.039  -0.858  -0.952  0.00  0.00    +0.009 A 
BRANCH  25  27
ATOM     27  C   LIG    1        2.583   1.099  -0.506  0.00  0.00    +0.119 C 
BRANCH  27  28
ATOM     28  N   LIG    1        3.831   0.333  -0.491  0.00  0.00    -0.297 NA
ATOM     29  C   LIG    1        4.979   1.134  -0.931  0.00  0.00    +0.103 C 
ATOM     30  C   LIG    1        6.160   0.231  -0.539  0.00  0.00    +0.071 C 
ATOM     31  C   LIG    1        5.712  -0.358   0.807  0.00  0.00    +0.035 C 
ATOM     32  C   LIG    1        4.195  -0.162   0.842  0.00  0.00    +0.086 C 
BRANCH  30  33
ATOM     33  N   LIG    1        7.524   0.790  -0.533  0.00  0.00    -0.304 NA
ATOM     34  C   LIG    1        7.660   2.041   0.211  0.00  0.00    +0.104 C 
ATOM     35  C   LIG    1        8.020   0.972  -1.899  0.00  0.00    +0.104 C 
ENDBRANCH  30  33
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   1  21
TORSDOF 6