REMARK  Name = BDB027985
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.114   0.173   0.154  0.00  0.00    +0.144 C 
ATOM      2  C   LIG    1       -1.120  -0.864   0.697  0.00  0.00    +0.236 C 
ATOM      3  O   LIG    1       -0.800  -1.911   1.255  0.00  0.00    -0.274 OA
ATOM      4  N   LIG    1       -2.451  -0.531   0.587  0.00  0.00    -0.255 N 
ATOM      5  H   LIG    1       -3.106  -1.201   0.968  0.00  0.00    +0.158 HD
ATOM      6  C   LIG    1       -3.000   0.626   0.094  0.00  0.00    +0.219 C 
ATOM      7  O   LIG    1       -4.212   0.817   0.131  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1       -2.034   1.662  -0.424  0.00  0.00    +0.098 C 
ATOM      9  C   LIG    1       -0.767   1.009  -0.955  0.00  0.00    +0.037 C 
ENDROOT
BRANCH   1  11
ATOM     10  C   LIG    1        1.010  -1.555  -1.230  0.00  0.00    +0.106 C 
ATOM     11  N   LIG    1        1.180  -0.400  -0.339  0.00  0.00    -0.285 NA
BRANCH  11  12
ATOM     12  C   LIG    1        2.077  -0.773   0.799  0.00  0.00    +0.205 C 
BRANCH  12  13
ATOM     13  C   LIG    1        2.808   0.476   1.296  0.00  0.00    +0.319 C 
ATOM     14  O   LIG    1        3.338   0.589   2.389  0.00  0.00    -0.250 OA
BRANCH  13  15
ATOM     15  O   LIG    1        2.837   1.453   0.351  0.00  0.00    -0.480 OA
ATOM     16  H   LIG    1        2.341   1.104  -0.427  0.00  0.00    +0.295 HD
ENDBRANCH  13  15
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   1  11
TORSDOF 4