REMARK  Name = BDB034821
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.457   0.865  -0.139  0.00  0.00    +0.051 A 
ATOM      2  C   LIG    1       -0.704   0.971   0.592  0.00  0.00    +0.109 A 
ATOM      3  N   LIG    1       -1.716   1.346  -0.257  0.00  0.00    -0.347 N 
ATOM      4  C   LIG    1       -1.211   1.506  -1.522  0.00  0.00    +0.088 A 
ATOM      5  C   LIG    1        0.134   1.205  -1.478  0.00  0.00    +0.042 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1        2.060   0.196   1.602  0.00  0.00    +0.222 C 
ATOM      7  N   LIG    1        1.714   0.501   0.301  0.00  0.00    -0.284 N 
ATOM      8  H   LIG    1        2.440   0.497  -0.408  0.00  0.00    +0.155 HD
ATOM      9  O   LIG    1        1.306   0.206   2.574  0.00  0.00    -0.275 OA
BRANCH   6  12
ATOM     10  N   LIG    1        4.604  -0.003  -0.313  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1        4.509   0.621   1.042  0.00  0.00    +0.129 C 
ATOM     12  C   LIG    1        3.510  -0.245   1.790  0.00  0.00    +0.095 C 
ATOM     13  C   LIG    1        3.775  -1.641   1.248  0.00  0.00    +0.034 C 
ATOM     14  C   LIG    1        4.192  -1.437  -0.203  0.00  0.00    +0.117 C 
BRANCH  10  16
ATOM     15  N   LIG    1        6.150   0.833  -2.090  0.00  0.00    -0.174 NA
ATOM     16  C   LIG    1        5.435   0.446  -1.267  0.00  0.00    +0.169 C 
ENDBRANCH  10  16
ENDBRANCH   6  12
ENDBRANCH   1   7
BRANCH   3  17
ATOM     17  C   LIG    1       -3.095   1.595   0.142  0.00  0.00    +0.156 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -3.985   0.417  -0.168  0.00  0.00    -0.028 A 
ATOM     19  C   LIG    1       -3.978  -0.719   0.655  0.00  0.00    +0.005 A 
ATOM     20  C   LIG    1       -4.798  -1.810   0.365  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -5.632  -1.779  -0.750  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -5.645  -0.659  -1.579  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -4.825   0.434  -1.292  0.00  0.00    +0.005 A 
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 5