REMARK  Name = BDB034984
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.647  -2.110   1.609  0.00  0.00    +0.046 C 
ATOM      2  C   LIG    1       -2.090  -0.971   0.736  0.00  0.00    -0.020 A 
ATOM      3  C   LIG    1       -1.146  -0.152   0.116  0.00  0.00    +0.093 A 
ATOM      4  C   LIG    1       -1.655   0.882  -0.694  0.00  0.00    +0.092 A 
ATOM      5  C   LIG    1       -0.724   1.693  -1.317  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1        0.645   1.490  -1.140  0.00  0.00    +0.030 A 
ATOM      7  C   LIG    1        1.073   0.454  -0.319  0.00  0.00    +0.073 A 
ATOM      8  N   LIG    1       -2.967   1.118  -0.891  0.00  0.00    -0.231 NA
ATOM      9  C   LIG    1       -3.846   0.316  -0.276  0.00  0.00    +0.117 A 
ATOM     10  N   LIG    1        0.180  -0.359   0.295  0.00  0.00    -0.245 NA
ATOM     11  C   LIG    1       -3.456  -0.736   0.533  0.00  0.00    +0.048 A 
ENDROOT
BRANCH   7  12
ATOM     12  C   LIG    1        2.493   0.154  -0.061  0.00  0.00    +0.018 A 
ATOM     13  C   LIG    1        2.906  -1.131   0.302  0.00  0.00    +0.120 A 
ATOM     14  N   LIG    1        4.189  -1.504   0.550  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        5.127  -0.543   0.445  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        4.842   0.766   0.104  0.00  0.00    +0.020 A 
ATOM     17  C   LIG    1        3.514   1.113  -0.149  0.00  0.00    +0.013 A 
ENDBRANCH   7  12
BRANCH   9  18
ATOM     18  N   LIG    1       -5.193   0.564  -0.517  0.00  0.00    -0.343 N 
ATOM     19  H   LIG    1       -5.247   1.398  -1.096  0.00  0.00    +0.144 HD
ATOM     20  H   LIG    1       -5.719   0.665   0.343  0.00  0.00    +0.144 HD
ENDBRANCH   9  18
TORSDOF 2