REMARK  Name = BDB060684
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.501  -0.965   0.006  0.00  0.00    +0.092 A 
ATOM      2  N   LIG    1        2.145  -0.876  -0.035  0.00  0.00    -0.241 NA
ATOM      3  C   LIG    1        1.500  -2.049  -0.267  0.00  0.00    +0.117 A 
ATOM      4  C   LIG    1        2.170  -3.251  -0.450  0.00  0.00    +0.154 A 
ATOM      5  O   LIG    1        1.288  -4.261  -0.663  0.00  0.00    -0.461 OA
ATOM      6  C   LIG    1        0.046  -3.706  -0.619  0.00  0.00    +0.206 A 
ATOM      7  C   LIG    1        3.552  -3.354  -0.412  0.00  0.00    +0.050 A 
ATOM      8  C   LIG    1        0.109  -2.346  -0.370  0.00  0.00    +0.046 A 
ATOM      9  C   LIG    1        4.222  -2.153  -0.174  0.00  0.00    +0.033 A 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        7.156   2.152   0.660  0.00  0.00    +0.172 C 
ATOM     11  N   LIG    1        5.792   1.694   0.551  0.00  0.00    -0.274 N 
ATOM     12  N   LIG    1        5.552   0.396   0.298  0.00  0.00    -0.170 NA
ATOM     13  C   LIG    1        4.208   0.301   0.260  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1        3.618   1.575   0.496  0.00  0.00    +0.051 A 
ATOM     15  C   LIG    1        4.666   2.446   0.678  0.00  0.00    +0.108 A 
ENDBRANCH   1  13
BRANCH   8  16
ATOM     16  C   LIG    1       -1.058  -1.479  -0.280  0.00  0.00    -0.013 A 
ATOM     17  C   LIG    1       -0.975  -0.137  -0.661  0.00  0.00    +0.009 A 
ATOM     18  C   LIG    1       -2.090   0.708  -0.583  0.00  0.00    +0.005 A 
ATOM     19  C   LIG    1       -3.329   0.242  -0.116  0.00  0.00    -0.042 A 
ATOM     20  C   LIG    1       -3.399  -1.109   0.270  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1       -2.285  -1.955   0.191  0.00  0.00    +0.009 A 
BRANCH  19  22
ATOM     22  C   LIG    1       -4.572   1.142  -0.015  0.00  0.00    -0.013 C 
ATOM     23  C   LIG    1       -5.705   0.563  -0.890  0.00  0.00    +0.015 C 
ATOM     24  C   LIG    1       -4.332   2.595  -0.483  0.00  0.00    +0.015 C 
ATOM     25  C   LIG    1       -5.047   1.208   1.453  0.00  0.00    +0.015 C 
ENDBRANCH  19  22
ENDBRANCH   8  16
TORSDOF 3