REMARK  Name = BDB036935
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.735  -0.850  -0.297  0.00  0.00    -0.291 NA
ATOM      2  C   LIG    1        0.022   0.235   0.340  0.00  0.00    +0.093 C 
ATOM      3  C   LIG    1        1.281  -0.437   0.926  0.00  0.00    +0.034 C 
ATOM      4  C   LIG    1        1.162  -1.904   0.506  0.00  0.00    +0.025 C 
ATOM      5  C   LIG    1       -0.336  -2.098   0.349  0.00  0.00    +0.086 C 
ENDROOT
BRANCH   1  12
ATOM      6  O   LIG    1       -5.750   1.464  -0.326  0.00  0.00    -0.275 OA
ATOM      7  C   LIG    1       -4.677   0.869  -0.372  0.00  0.00    +0.219 C 
ATOM      8  N   LIG    1       -4.097   0.367   0.766  0.00  0.00    -0.255 N 
ATOM      9  H   LIG    1       -4.589   0.549   1.629  0.00  0.00    +0.158 HD
ATOM     10  C   LIG    1       -2.925  -0.347   0.885  0.00  0.00    +0.236 C 
ATOM     11  O   LIG    1       -2.567  -0.731   1.997  0.00  0.00    -0.274 OA
ATOM     12  C   LIG    1       -2.188  -0.656  -0.435  0.00  0.00    +0.144 C 
ATOM     13  C   LIG    1       -2.465   0.457  -1.453  0.00  0.00    +0.037 C 
ATOM     14  C   LIG    1       -3.964   0.590  -1.670  0.00  0.00    +0.098 C 
ENDBRANCH   1  12
BRANCH   3  15
ATOM     15  C   LIG    1        2.591   0.205   0.528  0.00  0.00    -0.043 A 
ATOM     16  C   LIG    1        2.949   0.369  -0.819  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        4.163   0.963  -1.167  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        5.037   1.399  -0.174  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        4.697   1.240   1.167  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        3.482   0.646   1.517  0.00  0.00    +0.004 A 
ENDBRANCH   3  15
TORSDOF 2