REMARK  Name = BDB014020
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.972   0.327  -0.621  0.00  0.00    +0.160 C 
ATOM      2  C   LIG    1        0.619   0.128   0.062  0.00  0.00    +0.240 C 
ATOM      3  O   LIG    1        0.361  -0.969   0.579  0.00  0.00    -0.273 OA
ATOM      4  N   LIG    1       -0.293   1.186   0.062  0.00  0.00    -0.265 N 
ATOM      5  C   LIG    1        0.042   2.552  -0.221  0.00  0.00    +0.040 A 
ATOM      6  C   LIG    1        0.876   2.970  -1.278  0.00  0.00    -0.026 A 
ATOM      7  C   LIG    1        1.105   4.359  -1.458  0.00  0.00    +0.005 A 
ATOM      8  C   LIG    1        0.556   5.317  -0.613  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1       -0.239   4.909   0.442  0.00  0.00    +0.002 A 
ATOM     10  C   LIG    1        1.534   2.106  -2.330  0.00  0.00    +0.039 C 
ATOM     11  C   LIG    1       -0.487   3.548   0.632  0.00  0.00    +0.024 A 
ATOM     12  C   LIG    1        1.679   0.617  -2.084  0.00  0.00    +0.036 C 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1        4.083  -0.982  -0.677  0.00  0.00    +0.230 C 
ATOM     14  N   LIG    1        2.727  -0.917  -0.473  0.00  0.00    -0.303 N 
ATOM     15  H   LIG    1        2.211  -1.704  -0.088  0.00  0.00    +0.149 HD
ATOM     16  O   LIG    1        4.721  -0.016  -1.097  0.00  0.00    -0.274 OA
BRANCH  13  17
ATOM     17  C   LIG    1        4.726  -2.374  -0.425  0.00  0.00    +0.137 C 
ATOM     18  C   LIG    1        4.340  -2.977   0.925  0.00  0.00    +0.034 C 
BRANCH  17  20
ATOM     19  C   LIG    1        6.929  -1.691   0.458  0.00  0.00    +0.101 C 
ATOM     20  N   LIG    1        6.195  -2.313  -0.639  0.00  0.00    -0.309 NA
ATOM     21  H   LIG    1        6.343  -1.735  -1.472  0.00  0.00    +0.122 HD
ENDBRANCH  17  20
ENDBRANCH  13  17
ENDBRANCH   1  14
BRANCH   4  22
ATOM     22  C   LIG    1       -1.639   0.865   0.589  0.00  0.00    +0.149 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.482   0.004  -0.351  0.00  0.00    -0.022 A 
ATOM     24  C   LIG    1       -3.386  -1.026   0.110  0.00  0.00    -0.010 A 
ATOM     25  C   LIG    1       -3.979  -1.834  -0.911  0.00  0.00    -0.017 A 
ATOM     26  C   LIG    1       -4.792  -2.931  -0.599  0.00  0.00    +0.008 A 
ATOM     27  C   LIG    1       -5.063  -3.269   0.714  0.00  0.00    +0.001 A 
ATOM     28  C   LIG    1       -4.559  -2.475   1.730  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -3.779  -1.564  -2.272  0.00  0.00    +0.008 A 
ATOM     30  C   LIG    1       -2.996  -0.500  -2.686  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1       -3.763  -1.331   1.476  0.00  0.00    -0.036 A 
ATOM     32  C   LIG    1       -2.357   0.276  -1.735  0.00  0.00    +0.006 A 
BRANCH  31  33
ATOM     33  C   LIG    1       -3.386  -0.500   2.696  0.00  0.00    +0.020 C 
ATOM     34  C   LIG    1       -4.444  -0.142   3.726  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1       -3.887   0.922   2.840  0.00  0.00    +0.009 C 
ENDBRANCH  31  33
ENDBRANCH  22  23
ENDBRANCH   4  22
TORSDOF 6