REMARK  Name = BDB017150
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.111   0.833  -0.545  0.00  0.00    +0.167 C 
ATOM      2  O   LIG    1       -0.160   1.707  -1.413  0.00  0.00    -0.292 OA
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.285  -0.065  -0.408  0.00  0.00    +0.018 A 
ATOM      4  C   LIG    1       -2.557   0.523  -0.396  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1       -3.730  -0.255  -0.278  0.00  0.00    -0.014 A 
ATOM      6  C   LIG    1       -3.583  -1.663  -0.188  0.00  0.00    -0.018 A 
ATOM      7  C   LIG    1       -4.718  -2.477  -0.068  0.00  0.00    +0.008 A 
ATOM      8  C   LIG    1       -5.994  -1.921  -0.037  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -6.153  -0.542  -0.128  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1       -2.302  -2.240  -0.226  0.00  0.00    +0.009 A 
ATOM     11  C   LIG    1       -5.037   0.302  -0.249  0.00  0.00    -0.043 A 
ATOM     12  C   LIG    1       -5.269   1.787  -0.348  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1       -1.158  -1.449  -0.343  0.00  0.00    +0.012 A 
ENDBRANCH   1   3
BRANCH   1  16
ATOM     14  N   LIG    1        3.470  -0.217   0.405  0.00  0.00    -0.302 NA
ATOM     15  C   LIG    1        2.219  -0.091  -0.365  0.00  0.00    +0.095 C 
ATOM     16  C   LIG    1        1.115   0.695   0.354  0.00  0.00    +0.074 C 
ATOM     17  C   LIG    1        0.852   0.145   1.759  0.00  0.00    +0.014 C 
ATOM     18  C   LIG    1        2.159   0.033   2.541  0.00  0.00    +0.016 C 
ATOM     19  C   LIG    1        3.207  -0.754   1.749  0.00  0.00    +0.084 C 
BRANCH  14  20
ATOM     20  C   LIG    1        4.266   1.020   0.458  0.00  0.00    +0.084 C 
BRANCH  20  22
ATOM     21  C   LIG    1        5.700   0.410  -1.566  0.00  0.00    +0.005 C 
ATOM     22  C   LIG    1        4.839   1.470  -0.894  0.00  0.00    +0.012 C 
ENDBRANCH  20  22
ENDBRANCH  14  20
ENDBRANCH   1  16
TORSDOF 4