REMARK  Name = BDB027860
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.754  -1.051  -0.848  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1        1.939  -2.285  -0.203  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.837  -2.273   0.865  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        3.021  -3.483   1.519  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.418  -4.661   1.208  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.572  -4.640   0.165  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.498  -1.173   1.253  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        3.274  -0.046   0.559  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        1.302  -3.496  -0.563  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        2.430   0.051  -0.482  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        4.004   1.169   0.967  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        4.920   1.154   2.031  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        5.584   2.320   2.377  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        5.407   3.499   1.748  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        4.525   3.510   0.730  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        3.816   2.395   0.311  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1        0.854  -0.971  -1.936  0.00  0.00    -0.327 N 
ATOM     18  H   LIG    1       -0.049  -1.325  -1.620  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        0.684   0.363  -2.528  0.00  0.00    +0.121 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -0.303   1.217  -1.720  0.00  0.00    +0.126 C 
BRANCH  20  22
ATOM     21  C   LIG    1       -2.440   0.819  -0.562  0.00  0.00    +0.401 C 
ATOM     22  N   LIG    1       -1.601   0.570  -1.606  0.00  0.00    -0.280 N 
ATOM     23  H   LIG    1       -2.065   0.225  -2.435  0.00  0.00    +0.152 HD
ATOM     24  O   LIG    1       -2.147   1.447   0.441  0.00  0.00    -0.226 OA
BRANCH  21  25
ATOM     25  O   LIG    1       -3.640   0.264  -0.839  0.00  0.00    -0.445 OA
BRANCH  25  27
ATOM     26  C   LIG    1       -5.156   1.828   0.315  0.00  0.00    +0.055 C 
ATOM     27  C   LIG    1       -4.739   0.368   0.104  0.00  0.00    +0.107 C 
ATOM     28  C   LIG    1       -4.405  -0.330   1.427  0.00  0.00    +0.055 C 
ATOM     29  C   LIG    1       -5.900  -0.382  -0.566  0.00  0.00    +0.055 C 
ENDBRANCH  25  27
ENDBRANCH  21  25
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7