REMARK  Name = BDB002883
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.800   0.242   1.160  0.00  0.00    +0.262 C 
ATOM      2  C   LIG    1       -1.645  -0.998   0.773  0.00  0.00    +0.222 C 
ATOM      3  O   LIG    1       -1.379  -2.180   0.901  0.00  0.00    -0.287 OA
ATOM      4  C   LIG    1       -2.898  -0.530   0.183  0.00  0.00    +0.033 A 
ATOM      5  C   LIG    1       -2.888   0.852   0.055  0.00  0.00    +0.033 A 
ATOM      6  C   LIG    1       -3.953   1.539  -0.500  0.00  0.00    +0.012 A 
ATOM      7  C   LIG    1       -5.056   0.791  -0.921  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -5.069  -0.611  -0.790  0.00  0.00    +0.001 A 
ATOM      9  C   LIG    1       -3.978  -1.288  -0.235  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1       -1.619   1.394   0.537  0.00  0.00    +0.222 C 
ATOM     11  O   LIG    1       -1.281   2.557   0.381  0.00  0.00    -0.287 OA
ENDROOT
BRANCH   1  14
ATOM     12  O   LIG    1        1.413  -1.309   1.971  0.00  0.00    -0.270 OA
ATOM     13  C   LIG    1        1.540  -0.519   1.045  0.00  0.00    +0.250 C 
ATOM     14  N   LIG    1        0.525   0.282   0.587  0.00  0.00    -0.271 N 
ATOM     15  H   LIG    1        0.743   1.073  -0.009  0.00  0.00    +0.153 HD
BRANCH  13  16
ATOM     16  C   LIG    1        2.845  -0.334   0.388  0.00  0.00    +0.073 A 
ATOM     17  C   LIG    1        3.920   0.204   1.107  0.00  0.00    +0.054 A 
ATOM     18 CL   LIG    1        3.770   0.752   2.739  0.00  0.00    -0.083 Cl
ATOM     19  C   LIG    1        5.167   0.355   0.490  0.00  0.00    +0.021 A 
ATOM     20  C   LIG    1        5.347  -0.032  -0.837  0.00  0.00    +0.003 A 
ATOM     21  C   LIG    1        4.279  -0.568  -1.555  0.00  0.00    +0.021 A 
ATOM     22  C   LIG    1        3.029  -0.723  -0.946  0.00  0.00    +0.054 A 
ATOM     23 CL   LIG    1        1.759  -1.405  -1.901  0.00  0.00    -0.083 Cl
ENDBRANCH  13  16
ENDBRANCH   1  14
BRANCH   1  24
ATOM     24  O   LIG    1       -0.687   0.407   2.550  0.00  0.00    -0.359 OA
ATOM     25  H   LIG    1       -0.079  -0.311   2.826  0.00  0.00    +0.213 HD
ENDBRANCH   1  24
TORSDOF 3