REMARK  Name = BDB014208
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.842   0.224  -0.516  0.00  0.00    +0.018 A 
ATOM      2  N   LIG    1       -0.192   0.546   0.332  0.00  0.00    -0.356 N 
ATOM      3  H   LIG    1       -0.125   1.124   1.164  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1       -1.354  -0.064  -0.084  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1       -1.044  -0.808  -1.214  0.00  0.00    +0.089 A 
ATOM      6  N   LIG    1       -1.956  -1.558  -1.876  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1       -3.194  -1.558  -1.343  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1       -3.593  -0.841  -0.224  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1       -2.655  -0.038   0.427  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1        0.330  -0.616  -1.488  0.00  0.00    +0.051 A 
ENDROOT
BRANCH   9  11
ATOM     11  C   LIG    1       -2.952   0.775   1.626  0.00  0.00    +0.339 C 
ATOM     12  O   LIG    1       -2.099   1.069   2.447  0.00  0.00    -0.245 OA
BRANCH  11  13
ATOM     13  O   LIG    1       -4.229   1.199   1.703  0.00  0.00    -0.477 OA
ATOM     14  H   LIG    1       -4.752   1.099   0.887  0.00  0.00    +0.295 HD
ENDBRANCH  11  13
ENDBRANCH   9  11
BRANCH   1  15
ATOM     15  C   LIG    1        2.225   0.746  -0.308  0.00  0.00    +0.053 C 
BRANCH  15  17
ATOM     16  C   LIG    1        4.438   0.371   0.837  0.00  0.00    +0.004 C 
ATOM     17  C   LIG    1        3.027  -0.156   0.631  0.00  0.00    +0.003 C 
ENDBRANCH  15  17
ENDBRANCH   1  15
TORSDOF 4