REMARK  Name = BDB002773
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.029  -0.837  -1.691  0.00  0.00    -0.339 N 
ATOM      2  H   LIG    1        0.877  -1.747  -1.258  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.827  -0.010  -0.889  0.00  0.00    +0.030 A 
ATOM      4  C   LIG    1        2.719  -0.584   0.050  0.00  0.00    -0.027 A 
ATOM      5  C   LIG    1        2.777  -2.074   0.273  0.00  0.00    +0.046 C 
ATOM      6  C   LIG    1        3.562   0.239   0.822  0.00  0.00    +0.038 A 
ATOM      7  C   LIG    1        3.554   1.624   0.636  0.00  0.00    +0.127 A 
ATOM      8  C   LIG    1        2.722   2.200  -0.322  0.00  0.00    +0.034 A 
ATOM      9  C   LIG    1        1.882   1.381  -1.084  0.00  0.00    +0.025 A 
BRANCH   7  10
ATOM     10  N   LIG    1        4.437   2.475   1.443  0.00  0.00    +0.056 N 
ATOM     11  O   LIG    1        4.417   3.696   1.228  0.00  0.00    -0.126 OA
ATOM     12  O   LIG    1        5.152   1.925   2.293  0.00  0.00    -0.126 OA
ENDBRANCH   7  10
ENDBRANCH   1   3
BRANCH   1  13
ATOM     13  C   LIG    1       -0.254  -0.367  -2.215  0.00  0.00    +0.140 C 
BRANCH  13  16
ATOM     14  C   LIG    1       -2.743   1.217   0.206  0.00  0.00    +0.121 A 
ATOM     15  C   LIG    1       -1.789   1.043  -0.798  0.00  0.00    +0.054 A 
ATOM     16  C   LIG    1       -1.292  -0.233  -1.122  0.00  0.00    +0.015 A 
ATOM     17  C   LIG    1       -1.770  -1.353  -0.419  0.00  0.00    +0.125 A 
ATOM     18  C   LIG    1       -2.728  -1.176   0.584  0.00  0.00    +0.049 A 
ATOM     19  C   LIG    1       -3.211   0.102   0.894  0.00  0.00    +0.049 A 
BRANCH  14  21
ATOM     20  C   LIG    1       -4.072   2.748   1.447  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1       -3.129   2.512   0.409  0.00  0.00    -0.495 OA
ENDBRANCH  14  21
BRANCH  17  22
ATOM     22  O   LIG    1       -1.237  -2.563  -0.785  0.00  0.00    -0.495 OA
ATOM     23  C   LIG    1       -1.701  -3.718  -0.097  0.00  0.00    +0.277 C 
ENDBRANCH  17  22
ENDBRANCH  13  16
ENDBRANCH   1  13
TORSDOF 6