REMARK  Name = BDB014277
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.306   0.619   0.575  0.00  0.00    +0.086 A 
ATOM      2  C   LIG    1       -2.993   0.264   0.256  0.00  0.00    +0.080 A 
ATOM      3  C   LIG    1       -2.259   1.001  -0.664  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1       -0.986   0.399  -0.782  0.00  0.00    +0.060 A 
ATOM      5  C   LIG    1       -0.934  -0.679   0.090  0.00  0.00    +0.105 A 
ATOM      6  N   LIG    1       -2.749   2.090  -1.302  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -4.017   2.420  -0.979  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1       -2.181  -0.761   0.675  0.00  0.00    -0.349 N 
ATOM      9  H   LIG    1       -2.463  -1.485   1.327  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1       -4.820   1.742  -0.075  0.00  0.00    +0.037 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        0.096  -1.668   0.364  0.00  0.00    +0.267 C 
ATOM     12  N   LIG    1        1.440  -1.375   0.078  0.00  0.00    -0.266 N 
ATOM     13  C   LIG    1        2.071  -0.098   0.210  0.00  0.00    +0.040 A 
ATOM     14  C   LIG    1        3.287   0.153  -0.455  0.00  0.00    -0.026 A 
ATOM     15  C   LIG    1        3.895   1.415  -0.371  0.00  0.00    +0.005 A 
ATOM     16  C   LIG    1        3.333   2.416   0.416  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        2.169   2.158   1.131  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1        3.936  -0.928  -1.275  0.00  0.00    +0.038 C 
ATOM     19  C   LIG    1        3.720  -2.252  -0.567  0.00  0.00    +0.024 C 
ATOM     20  C   LIG    1        1.550   0.909   1.036  0.00  0.00    +0.024 A 
ATOM     21  C   LIG    1        2.231  -2.510  -0.399  0.00  0.00    +0.114 C 
ATOM     22  O   LIG    1       -0.239  -2.789   0.752  0.00  0.00    -0.268 OA
ENDBRANCH   5  11
BRANCH   1  24
ATOM     23  O   LIG    1       -6.294   0.167   1.831  0.00  0.00    -0.245 OA
ATOM     24  C   LIG    1       -5.148  -0.116   1.535  0.00  0.00    +0.339 C 
BRANCH  24  25
ATOM     25  O   LIG    1       -4.522  -1.172   2.087  0.00  0.00    -0.477 OA
ATOM     26  H   LIG    1       -5.201  -1.552   2.686  0.00  0.00    +0.295 HD
ENDBRANCH  24  25
ENDBRANCH   1  24
TORSDOF 3