REMARK  Name = BDB047125
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.159   0.474   0.443  0.00  0.00    +0.230 A 
ATOM      2  N   LIG    1       -0.262  -0.504   0.258  0.00  0.00    -0.207 NA
ATOM      3  CA  LIG    1        0.968  -0.133  -0.159  0.00  0.00    +0.152 A 
ATOM      4  C   LIG    1        1.325   1.175  -0.403  0.00  0.00    +0.055 A 
ATOM      5  C   LIG    1        0.333   2.096  -0.196  0.00  0.00    +0.117 A 
ATOM      6  N   LIG    1       -0.905   1.771   0.217  0.00  0.00    -0.222 NA
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1       -2.456   0.146   0.878  0.00  0.00    -0.252 N 
ATOM      8  H   LIG    1       -3.072   0.930   0.666  0.00  0.00    +0.169 HD
BRANCH   7   9
ATOM      9  N   LIG    1       -2.941  -1.171   0.677  0.00  0.00    -0.254 NA
ATOM     10  H   LIG    1       -2.289  -1.820   1.135  0.00  0.00    +0.140 HD
ATOM     11  H   LIG    1       -2.862  -1.417  -0.314  0.00  0.00    +0.140 HD
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   3  12
ATOM     12  C   LIG    1        1.940  -1.251  -0.352  0.00  0.00    +0.355 C 
ATOM     13  O   LIG    1        1.729  -2.440  -0.199  0.00  0.00    -0.243 OA
BRANCH  12  14
ATOM     14  OXT LIG    1        3.161  -0.822  -0.738  0.00  0.00    -0.476 OA
ATOM     15  HXT LIG    1        3.675  -1.655  -0.816  0.00  0.00    +0.295 HD
ENDBRANCH  12  14
ENDBRANCH   3  12
TORSDOF 4