REMARK  Name = BDB014893
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.473   4.892   1.976  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -4.338   3.750   1.502  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -3.691   2.651   0.950  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1       -2.267   2.686   0.561  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -1.734   1.310   0.376  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1       -0.416   0.842   0.134  0.00  0.00    +0.150 A 
ATOM      7  N   LIG    1       -0.409  -0.492   0.037  0.00  0.00    -0.155 NA
ATOM      8  N   LIG    1       -1.685  -0.879   0.212  0.00  0.00    -0.261 N 
ATOM      9  C   LIG    1       -2.521   0.178   0.397  0.00  0.00    +0.048 A 
ATOM     10  C   LIG    1       -3.988   0.172   0.619  0.00  0.00    +0.074 C 
ATOM     11  C   LIG    1       -4.531   1.591   0.353  0.00  0.00    +0.114 C 
ATOM     12  O   LIG    1       -5.561   3.814   1.626  0.00  0.00    -0.276 OA
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1       -2.014  -2.282   0.200  0.00  0.00    +0.135 C 
ATOM     14  C   LIG    1       -1.652  -3.001  -1.088  0.00  0.00    +0.186 C 
ATOM     15  O   LIG    1       -1.551  -4.398  -0.758  0.00  0.00    -0.378 OA
ATOM     16  C   LIG    1       -1.464  -4.519   0.669  0.00  0.00    +0.162 C 
ATOM     17  C   LIG    1       -1.288  -3.123   1.231  0.00  0.00    +0.057 C 
ENDBRANCH   8  13
BRANCH   6  18
ATOM     18  N   LIG    1        0.646   1.681   0.037  0.00  0.00    -0.298 N 
ATOM     19  H   LIG    1        0.479   2.668   0.182  0.00  0.00    +0.154 HD
BRANCH  18  20
ATOM     20  C   LIG    1        2.004   1.442  -0.282  0.00  0.00    +0.033 A 
ATOM     21  C   LIG    1        2.498   0.194  -0.693  0.00  0.00    +0.028 A 
ATOM     22  C   LIG    1        3.860  -0.025  -0.987  0.00  0.00    -0.026 A 
ATOM     23  C   LIG    1        4.738   1.065  -0.839  0.00  0.00    +0.005 A 
ATOM     24  C   LIG    1        4.273   2.312  -0.428  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1        2.919   2.496  -0.150  0.00  0.00    +0.023 A 
BRANCH  22  26
ATOM     26  C   LIG    1        4.399  -1.399  -1.427  0.00  0.00    +0.077 C 
ATOM     27  C   LIG    1        5.262  -1.977  -0.285  0.00  0.00    +0.032 C 
ATOM     28  C   LIG    1        3.301  -2.436  -1.753  0.00  0.00    +0.032 C 
BRANCH  26  29
ATOM     29  C   LIG    1        5.244  -1.267  -2.646  0.00  0.00    +0.073 C 
ATOM     30  N   LIG    1        5.920  -1.177  -3.587  0.00  0.00    -0.196 NA
ENDBRANCH  26  29
ENDBRANCH  22  26
ENDBRANCH  18  20
ENDBRANCH   6  18
TORSDOF 5