REMARK  Name = BDB014211
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.187   0.291  -0.292  0.00  0.00    +0.086 A 
ATOM      2  C   LIG    1       -0.918  -0.251  -0.075  0.00  0.00    +0.079 A 
ATOM      3  C   LIG    1       -0.746  -1.617   0.120  0.00  0.00    +0.090 A 
ATOM      4  C   LIG    1        0.636  -1.855   0.312  0.00  0.00    +0.051 A 
ATOM      5  C   LIG    1        1.275  -0.637   0.231  0.00  0.00    +0.022 A 
ATOM      6  N   LIG    1       -1.774  -2.498   0.114  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -2.992  -1.955  -0.098  0.00  0.00    +0.112 A 
ATOM      8  N   LIG    1        0.330   0.327  -0.003  0.00  0.00    -0.356 N 
ATOM      9  H   LIG    1        0.505   1.319  -0.110  0.00  0.00    +0.166 HD
ATOM     10  C   LIG    1       -3.253  -0.609  -0.301  0.00  0.00    +0.037 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        2.802  -0.417   0.381  0.00  0.00    +0.036 C 
ATOM     12  C   LIG    1        3.308   0.838   1.040  0.00  0.00    +0.010 C 
ATOM     13  C   LIG    1        3.481   0.647  -0.440  0.00  0.00    +0.010 C 
ENDBRANCH   5  11
BRANCH   1  15
ATOM     14  O   LIG    1       -1.442   2.559  -0.496  0.00  0.00    -0.245 OA
ATOM     15  C   LIG    1       -2.346   1.743  -0.497  0.00  0.00    +0.339 C 
BRANCH  15  16
ATOM     16  O   LIG    1       -3.626   2.102  -0.693  0.00  0.00    -0.477 OA
ATOM     17  H   LIG    1       -3.589   3.074  -0.813  0.00  0.00    +0.295 HD
ENDBRANCH  15  16
ENDBRANCH   1  15
TORSDOF 3