REMARK  Name = BDB014805
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.710  -0.322  -0.202  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -1.000  -0.666  -1.108  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.685   0.083   0.651  0.00  0.00    +0.150 A 
ATOM      4  C   LIG    1       -3.063  -0.021   0.318  0.00  0.00    +0.032 A 
ATOM      5  C   LIG    1       -3.739  -0.546  -0.897  0.00  0.00    +0.148 C 
ATOM      6  N   LIG    1       -5.193  -0.299  -0.841  0.00  0.00    -0.297 N 
ATOM      7  C   LIG    1       -5.847  -0.375   0.485  0.00  0.00    +0.114 C 
ATOM      8  C   LIG    1       -5.210   0.567   1.529  0.00  0.00    +0.074 C 
ATOM      9  C   LIG    1       -5.876  -0.458  -2.040  0.00  0.00    +0.213 C 
ATOM     10  O   LIG    1       -5.301  -0.702  -3.101  0.00  0.00    -0.276 OA
ATOM     11  C   LIG    1       -7.375  -0.307  -2.010  0.00  0.00    +0.109 C 
ATOM     12  C   LIG    1       -3.738   0.472   1.414  0.00  0.00    +0.047 A 
ATOM     13  N   LIG    1       -2.789   0.854   2.306  0.00  0.00    -0.269 N 
ATOM     14  C   LIG    1       -2.973   1.454   3.604  0.00  0.00    +0.172 C 
ATOM     15  N   LIG    1       -1.542   0.603   1.876  0.00  0.00    -0.156 NA
ENDBRANCH   1   3
BRANCH   1  19
ATOM     16  C   LIG    1        3.551  -0.363   0.004  0.00  0.00    -0.014 A 
ATOM     17  C   LIG    1        2.796   0.154   1.064  0.00  0.00    +0.010 A 
ATOM     18  C   LIG    1        1.394   0.179   1.014  0.00  0.00    +0.024 A 
ATOM     19  C   LIG    1        0.699  -0.307  -0.095  0.00  0.00    +0.032 A 
ATOM     20  C   LIG    1        1.458  -0.830  -1.155  0.00  0.00    +0.024 A 
ATOM     21  C   LIG    1        2.858  -0.857  -1.108  0.00  0.00    +0.010 A 
BRANCH  16  23
ATOM     22  C   LIG    1        5.850   0.271  -0.858  0.00  0.00    +0.128 A 
ATOM     23  C   LIG    1        5.025  -0.407   0.069  0.00  0.00    +0.024 A 
ATOM     24  C   LIG    1        5.640  -1.152   1.095  0.00  0.00    +0.012 A 
ATOM     25  C   LIG    1        7.029  -1.231   1.201  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        7.829  -0.564   0.281  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        7.245   0.182  -0.745  0.00  0.00    +0.046 A 
BRANCH  22  29
ATOM     28  C   LIG    1        5.999   1.799  -2.693  0.00  0.00    +0.277 C 
ATOM     29  O   LIG    1        5.206   0.992  -1.834  0.00  0.00    -0.495 OA
ENDBRANCH  22  29
ENDBRANCH  16  23
ENDBRANCH   1  19
TORSDOF 4