REMARK  Name = BDB017250
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.529  -1.769   1.581  0.00  0.00    -0.292 OA
ATOM      2  C   LIG    1       -0.568  -0.794   0.830  0.00  0.00    +0.167 C 
ENDROOT
BRANCH   2   3
ATOM      3  C   LIG    1       -1.895  -0.393   0.259  0.00  0.00    +0.018 A 
ATOM      4  C   LIG    1       -3.049  -0.988   0.788  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1       -4.329  -0.669   0.303  0.00  0.00    -0.014 A 
ATOM      6  C   LIG    1       -4.472   0.280  -0.738  0.00  0.00    +0.024 A 
ATOM      7  C   LIG    1       -5.782   0.576  -1.184  0.00  0.00    +0.125 A 
ATOM      8  C   LIG    1       -6.900  -0.063  -0.652  0.00  0.00    +0.046 A 
ATOM      9  C   LIG    1       -6.742  -0.998   0.364  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1       -3.297   0.855  -1.274  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1       -5.466  -1.294   0.841  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1       -2.028   0.524  -0.783  0.00  0.00    +0.012 A 
BRANCH   7  13
ATOM     13  O   LIG    1       -6.047   1.507  -2.154  0.00  0.00    -0.506 OA
ATOM     14  H   LIG    1       -5.321   2.149  -2.172  0.00  0.00    +0.292 HD
ENDBRANCH   7  13
ENDBRANCH   2   3
BRANCH   2  15
ATOM     15  C   LIG    1        0.685   0.003   0.472  0.00  0.00    +0.074 C 
ATOM     16  C   LIG    1        1.961  -0.768   0.878  0.00  0.00    +0.095 C 
ATOM     17  N   LIG    1        3.178   0.056   0.875  0.00  0.00    -0.301 NA
ATOM     18  C   LIG    1        3.058   1.322   0.169  0.00  0.00    +0.084 C 
ATOM     19  C   LIG    1        1.947   2.173   0.793  0.00  0.00    +0.016 C 
ATOM     20  C   LIG    1        0.687   1.376   1.146  0.00  0.00    +0.014 C 
BRANCH  17  21
ATOM     21  C   LIG    1        4.404  -0.689   0.603  0.00  0.00    +0.088 C 
BRANCH  21  22
ATOM     22  C   LIG    1        4.589  -1.062  -0.840  0.00  0.00    +0.003 C 
ATOM     23  C   LIG    1        5.956  -1.471  -1.332  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1        5.356  -0.171  -1.787  0.00  0.00    +0.005 C 
ENDBRANCH  21  22
ENDBRANCH  17  21
ENDBRANCH   2  15
TORSDOF 5