REMARK  Name = BDB014243
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.004  -1.320  -0.225  0.00  0.00    +0.053 A 
ATOM      2  N   LIG    1        0.842  -0.620   0.607  0.00  0.00    -0.354 N 
ATOM      3  H   LIG    1        0.640  -0.366   1.570  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1        2.022  -0.339  -0.041  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1        1.933  -0.895  -1.310  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1        2.936  -0.828  -2.216  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1        4.050  -0.195  -1.794  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1        4.221   0.396  -0.551  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        3.167   0.352   0.364  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1        0.660  -1.499  -1.427  0.00  0.00    +0.054 A 
ENDROOT
BRANCH   9  11
ATOM     11  C   LIG    1        3.228   0.943   1.716  0.00  0.00    +0.339 C 
ATOM     12  O   LIG    1        2.592   0.498   2.657  0.00  0.00    -0.245 OA
BRANCH  11  13
ATOM     13  O   LIG    1        4.012   2.037   1.802  0.00  0.00    -0.477 OA
ATOM     14  H   LIG    1        4.273   2.426   0.948  0.00  0.00    +0.295 HD
ENDBRANCH  11  13
ENDBRANCH   9  11
BRANCH   1  15
ATOM     15  C   LIG    1       -1.367  -1.755   0.216  0.00  0.00    +0.211 C 
BRANCH  15  19
ATOM     16  C   LIG    1       -4.554   1.806  -0.670  0.00  0.00    +0.172 C 
ATOM     17  N   LIG    1       -3.681   0.961   0.108  0.00  0.00    -0.274 N 
ATOM     18  N   LIG    1       -2.991  -0.017  -0.505  0.00  0.00    -0.173 NA
ATOM     19  C   LIG    1       -2.291  -0.596   0.487  0.00  0.00    +0.097 A 
ATOM     20  C   LIG    1       -2.560   0.028   1.733  0.00  0.00    +0.047 A 
ATOM     21  C   LIG    1       -3.457   1.029   1.450  0.00  0.00    +0.108 A 
ENDBRANCH  15  19
BRANCH  15  22
ATOM     22  O   LIG    1       -1.148  -2.553   1.383  0.00  0.00    -0.379 OA
ATOM     23  H   LIG    1       -0.616  -3.309   1.083  0.00  0.00    +0.211 HD
ENDBRANCH  15  22
ENDBRANCH   1  15
TORSDOF 5