REMARK  Name = BDB034956
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.660   1.880   1.233  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -3.038   0.611   0.720  0.00  0.00    -0.020 A 
ATOM      3  C   LIG    1       -1.659   0.533   0.531  0.00  0.00    +0.092 A 
ATOM      4  C   LIG    1       -1.163  -0.695   0.047  0.00  0.00    +0.092 A 
ATOM      5  C   LIG    1        0.207  -0.789  -0.149  0.00  0.00    +0.040 A 
ATOM      6  C   LIG    1        1.072   0.279   0.120  0.00  0.00    +0.002 A 
ATOM      7  C   LIG    1        0.471   1.439   0.595  0.00  0.00    +0.120 A 
ATOM      8  N   LIG    1       -1.937  -1.763  -0.231  0.00  0.00    -0.231 NA
ATOM      9  C   LIG    1       -3.258  -1.661  -0.039  0.00  0.00    +0.117 A 
ATOM     10  N   LIG    1       -0.858   1.588   0.802  0.00  0.00    -0.253 NA
ATOM     11  C   LIG    1       -3.845  -0.497   0.432  0.00  0.00    +0.048 A 
ENDROOT
BRANCH   6  12
ATOM     12  C   LIG    1        2.524   0.178  -0.086  0.00  0.00    -0.016 A 
ATOM     13  C   LIG    1        3.255  -0.905   0.430  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1        4.636  -1.002   0.238  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1        5.311  -0.016  -0.476  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        4.607   1.065  -0.999  0.00  0.00    +0.001 A 
ATOM     17  C   LIG    1        3.226   1.161  -0.805  0.00  0.00    +0.008 A 
ENDBRANCH   6  12
BRANCH   9  18
ATOM     18  N   LIG    1       -4.045  -2.777  -0.333  0.00  0.00    -0.343 N 
ATOM     19  H   LIG    1       -4.725  -2.539  -1.048  0.00  0.00    +0.144 HD
ATOM     20  H   LIG    1       -4.548  -3.071   0.498  0.00  0.00    +0.144 HD
ENDBRANCH   9  18
TORSDOF 2