REMARK  Name = BDB013869
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.370  -0.383   0.748  0.00  0.00    -0.338 N 
ATOM      2  H   LIG    1       -1.154  -1.074   0.012  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   4
ATOM      3  C   LIG    1       -3.221   0.238  -0.756  0.00  0.00    +0.082 A 
ATOM      4  C   LIG    1       -2.325   0.544   0.289  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -2.562   1.763   0.930  0.00  0.00    +0.134 A 
ATOM      6  N   LIG    1       -3.520   2.663   0.592  0.00  0.00    -0.261 NA
ATOM      7  C   LIG    1       -4.328   2.333  -0.431  0.00  0.00    +0.111 A 
ATOM      8  C   LIG    1       -4.224   1.145  -1.126  0.00  0.00    +0.036 A 
BRANCH   3  10
ATOM      9  O   LIG    1       -2.129  -1.791  -1.484  0.00  0.00    -0.245 OA
ATOM     10  C   LIG    1       -3.084  -1.035  -1.511  0.00  0.00    +0.339 C 
BRANCH  10  11
ATOM     11  O   LIG    1       -4.158  -1.312  -2.276  0.00  0.00    -0.477 OA
ATOM     12  H   LIG    1       -3.933  -2.172  -2.689  0.00  0.00    +0.295 HD
ENDBRANCH  10  11
ENDBRANCH   3  10
ENDBRANCH   1   4
BRANCH   1  13
ATOM     13  C   LIG    1       -0.137   0.124   1.370  0.00  0.00    +0.149 C 
BRANCH  13  14
ATOM     14  C   LIG    1        0.844  -1.044   1.611  0.00  0.00    +0.228 C 
ATOM     15  O   LIG    1        1.278  -1.601   0.355  0.00  0.00    -0.480 OA
ATOM     16  C   LIG    1        2.346  -0.933  -0.186  0.00  0.00    +0.163 A 
ATOM     17  C   LIG    1        3.089   0.025   0.510  0.00  0.00    +0.162 A 
ATOM     18  C   LIG    1        4.131   0.698  -0.124  0.00  0.00    +0.049 A 
ATOM     19  C   LIG    1        4.453   0.390  -1.447  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1        3.727  -0.585  -2.135  0.00  0.00    +0.004 A 
ATOM     21  O   LIG    1        2.829   0.372   1.811  0.00  0.00    -0.485 OA
ATOM     22  C   LIG    1        2.673  -1.246  -1.504  0.00  0.00    +0.049 A 
ATOM     23  C   LIG    1        2.045  -0.634   2.459  0.00  0.00    +0.275 C 
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 5