REMARK  Name = BDB013856
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.697  -0.329  -1.022  0.00  0.00    -0.338 N 
ATOM      2  H   LIG    1       -0.657  -0.858  -0.142  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   4
ATOM      3  C   LIG    1       -3.008   0.140  -0.304  0.00  0.00    +0.082 A 
ATOM      4  C   LIG    1       -1.879   0.431  -1.098  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -2.074   1.426  -2.059  0.00  0.00    +0.134 A 
ATOM      6  N   LIG    1       -3.212   2.144  -2.234  0.00  0.00    -0.261 NA
ATOM      7  C   LIG    1       -4.250   1.841  -1.434  0.00  0.00    +0.111 A 
ATOM      8  C   LIG    1       -4.201   0.857  -0.468  0.00  0.00    +0.036 A 
BRANCH   3  10
ATOM      9  O   LIG    1       -1.904  -1.380   1.209  0.00  0.00    -0.245 OA
ATOM     10  C   LIG    1       -2.927  -0.897   0.756  0.00  0.00    +0.339 C 
BRANCH  10  11
ATOM     11  O   LIG    1       -4.135  -1.284   1.207  0.00  0.00    -0.477 OA
ATOM     12  H   LIG    1       -3.931  -1.978   1.869  0.00  0.00    +0.295 HD
ENDBRANCH  10  11
ENDBRANCH   3  10
ENDBRANCH   1   4
BRANCH   1  13
ATOM     13  C   LIG    1        0.572   0.333  -1.308  0.00  0.00    +0.138 C 
BRANCH  13  14
ATOM     14  C   LIG    1        1.715  -0.573  -0.927  0.00  0.00    -0.009 A 
ATOM     15  C   LIG    1        2.204  -0.673   0.394  0.00  0.00    -0.037 A 
ATOM     16  C   LIG    1        3.237  -1.597   0.620  0.00  0.00    +0.024 A 
ATOM     17  C   LIG    1        3.746  -2.343  -0.431  0.00  0.00    +0.111 A 
ATOM     18  N   LIG    1        3.296  -2.254  -1.695  0.00  0.00    -0.263 NA
ATOM     19  C   LIG    1        2.285  -1.386  -1.909  0.00  0.00    +0.116 A 
BRANCH  15  20
ATOM     20  C   LIG    1        1.626   0.126   1.545  0.00  0.00    +0.019 C 
ATOM     21  C   LIG    1        1.851   1.620   1.616  0.00  0.00    +0.009 C 
ATOM     22  C   LIG    1        2.524   0.723   2.606  0.00  0.00    +0.009 C 
ENDBRANCH  15  20
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 6