REMARK  Name = BDB014760
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.103  -0.143   0.578  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -0.173  -0.131  -0.430  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -4.098   0.633  -3.236  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -4.975   0.028  -2.168  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -4.372  -0.291  -0.957  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -2.903  -0.329  -0.794  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -2.527  -0.324   0.643  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.259  -0.240   1.283  0.00  0.00    +0.150 A 
ATOM      9  N   LIG    1       -1.406  -0.282   2.612  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -2.730  -0.376   2.824  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -3.222  -0.423   4.179  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.441  -0.426   1.670  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.907  -0.545   1.492  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.186  -1.008   0.048  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -6.174  -0.151  -2.386  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        1.245  -0.027   0.994  0.00  0.00    +0.033 A 
ATOM     17  C   LIG    1        2.251   0.015   0.008  0.00  0.00    +0.032 A 
ATOM     18  C   LIG    1        3.611   0.128   0.340  0.00  0.00    -0.013 A 
ATOM     19  C   LIG    1        3.973   0.195   1.689  0.00  0.00    +0.009 A 
ATOM     20  C   LIG    1        2.993   0.150   2.679  0.00  0.00    +0.002 A 
ATOM     21  C   LIG    1        1.644   0.039   2.331  0.00  0.00    +0.023 A 
BRANCH  18  22
ATOM     22  C   LIG    1        4.616   0.165  -0.709  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1        5.808   0.856  -0.647  0.00  0.00    +0.116 A 
ATOM     24  N   LIG    1        6.440   0.641  -1.838  0.00  0.00    -0.274 N 
ATOM     25  C   LIG    1        7.722   1.161  -2.247  0.00  0.00    +0.172 C 
ATOM     26  N   LIG    1        5.744  -0.142  -2.681  0.00  0.00    -0.179 NA
ATOM     27  C   LIG    1        4.637  -0.432  -1.992  0.00  0.00    +0.142 A 
ENDBRANCH  18  22
ENDBRANCH   1  16
TORSDOF 3