REMARK  Name = BDB018217
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.169   0.169  -0.560  0.00  0.00    +0.021 A 
ATOM      2  C   LIG    1        0.082   0.400   0.255  0.00  0.00    +0.117 A 
ATOM      3  N   LIG    1       -0.949   0.783  -0.567  0.00  0.00    -0.263 N 
ATOM      4  N   LIG    1       -0.591   0.816  -1.873  0.00  0.00    -0.178 NA
ATOM      5  C   LIG    1        0.690   0.442  -1.861  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1  13
ATOM      6  C   LIG    1        4.080  -2.374   2.639  0.00  0.00    +0.049 C 
ATOM      7  C   LIG    1        3.865  -1.500   1.446  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1        5.087  -1.075   0.692  0.00  0.00    +0.254 A 
ATOM      9  O   LIG    1        6.200  -1.426   1.076  0.00  0.00    -0.267 OA
ATOM     10  N   LIG    1        4.859  -0.284  -0.433  0.00  0.00    -0.317 N 
ATOM     11  C   LIG    1        5.994   0.173  -1.220  0.00  0.00    +0.152 C 
ATOM     12  C   LIG    1        3.588   0.109  -0.822  0.00  0.00    +0.097 A 
ATOM     13  C   LIG    1        2.477  -0.250  -0.149  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1        2.656  -1.095   1.023  0.00  0.00    +0.018 A 
ENDBRANCH   1  13
BRANCH   3  15
ATOM     15  C   LIG    1       -2.313   1.138  -0.125  0.00  0.00    +0.140 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -3.175  -0.106   0.047  0.00  0.00    -0.023 A 
ATOM     17  C   LIG    1       -3.846  -0.331   1.262  0.00  0.00    +0.006 A 
ATOM     18  C   LIG    1       -4.650  -1.459   1.434  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -4.799  -2.375   0.395  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -4.149  -2.163  -0.818  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -3.345  -1.036  -0.993  0.00  0.00    +0.006 A 
ENDBRANCH  15  16
BRANCH  15  22
ATOM     22  C   LIG    1       -3.001   2.139  -1.029  0.00  0.00    +0.018 C 
ATOM     23  C   LIG    1       -2.754   3.621  -0.865  0.00  0.00    +0.006 C 
ATOM     24  C   LIG    1       -4.092   3.042  -0.499  0.00  0.00    +0.006 C 
ENDBRANCH  15  22
ENDBRANCH   3  15
TORSDOF 4