REMARK  Name = BDB013851
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.914   1.298  -0.101  0.00  0.00    -0.338 N 
ATOM      2  H   LIG    1        1.165   2.257   0.166  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   4
ATOM      3  C   LIG    1        3.346   0.928  -0.012  0.00  0.00    +0.082 A 
ATOM      4  C   LIG    1        2.022   0.439   0.004  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1        1.911  -0.954  -0.016  0.00  0.00    +0.134 A 
ATOM      6  N   LIG    1        2.947  -1.831   0.012  0.00  0.00    -0.261 NA
ATOM      7  C   LIG    1        4.185  -1.309   0.021  0.00  0.00    +0.111 A 
ATOM      8  C   LIG    1        4.436   0.047   0.005  0.00  0.00    +0.036 A 
BRANCH   3  10
ATOM      9  O   LIG    1        2.778   3.261   0.243  0.00  0.00    -0.245 OA
ATOM     10  C   LIG    1        3.599   2.393   0.001  0.00  0.00    +0.339 C 
BRANCH  10  11
ATOM     11  O   LIG    1        4.874   2.711  -0.290  0.00  0.00    -0.477 OA
ATOM     12  H   LIG    1        4.888   3.691  -0.264  0.00  0.00    +0.295 HD
ENDBRANCH  10  11
ENDBRANCH   3  10
ENDBRANCH   1   4
BRANCH   1  13
ATOM     13  C   LIG    1       -0.378   0.904   0.464  0.00  0.00    +0.137 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -1.255   0.162  -0.530  0.00  0.00    -0.027 A 
ATOM     15  C   LIG    1       -2.191  -0.807  -0.085  0.00  0.00    -0.038 A 
ATOM     16  C   LIG    1       -2.966  -1.467  -1.061  0.00  0.00    +0.024 A 
ATOM     17  C   LIG    1       -2.860  -1.155  -2.415  0.00  0.00    +0.041 A 
ATOM     18 CL   LIG    1       -3.839  -1.982  -3.563  0.00  0.00    -0.084 Cl
ATOM     19  C   LIG    1       -1.973  -0.177  -2.840  0.00  0.00    +0.020 A 
ATOM     20  C   LIG    1       -1.179   0.480  -1.903  0.00  0.00    +0.007 A 
BRANCH  15  21
ATOM     21  C   LIG    1       -2.353  -1.177   1.377  0.00  0.00    +0.019 C 
ATOM     22  C   LIG    1       -2.869  -0.151   2.362  0.00  0.00    +0.009 C 
ATOM     23  C   LIG    1       -3.731  -1.316   1.987  0.00  0.00    +0.009 C 
ENDBRANCH  15  21
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 6