REMARK  Name = BDB060355
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.672   0.203  -0.164  0.00  0.00    +0.129 A 
ATOM      2  N   LIG    1        3.301   0.103   0.009  0.00  0.00    -0.226 N 
ATOM      3  C   LIG    1        2.658   0.718  -1.053  0.00  0.00    +0.085 A 
ATOM      4  C   LIG    1        1.239   0.729  -1.068  0.00  0.00    +0.039 A 
ATOM      5  C   LIG    1        0.557   0.148  -0.069  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1        1.388  -0.487   0.990  0.00  0.00    +0.142 A 
ATOM      7  C   LIG    1        3.620   1.206  -1.906  0.00  0.00    +0.069 A 
ATOM      8 CL   LIG    1        3.393   2.050  -3.363  0.00  0.00    -0.081 Cl
ATOM      9  N   LIG    1        2.681  -0.527   1.044  0.00  0.00    -0.174 NA
ATOM     10  C   LIG    1        4.878   0.886  -1.357  0.00  0.00    +0.055 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -0.867   0.094  -0.018  0.00  0.00    +0.021 A 
ATOM     12  S   LIG    1       -1.835   1.473  -0.404  0.00  0.00    -0.093 S 
ATOM     13  C   LIG    1       -3.275   0.640  -0.094  0.00  0.00    -0.004 A 
ATOM     14  C   LIG    1       -4.628   1.249  -0.273  0.00  0.00    +0.058 C 
ATOM     15  C   LIG    1       -5.689   0.339   0.381  0.00  0.00    +0.086 C 
ATOM     16  N   LIG    1       -5.470  -1.087   0.076  0.00  0.00    -0.312 NA
ATOM     17  H   LIG    1       -6.237  -1.636   0.458  0.00  0.00    +0.122 HD
ATOM     18  C   LIG    1       -4.209  -1.581   0.657  0.00  0.00    +0.117 C 
ATOM     19  C   LIG    1       -3.075  -0.664   0.304  0.00  0.00    -0.023 A 
ATOM     20  C   LIG    1       -1.679  -0.970   0.353  0.00  0.00    +0.021 A 
ENDBRANCH   5  11
BRANCH   1  24
ATOM     21  N   LIG    1        6.912  -0.464   0.263  0.00  0.00    -0.324 N 
ATOM     22  H   LIG    1        7.088  -0.482  -0.729  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1        7.565  -0.939   0.871  0.00  0.00    +0.145 HD
ATOM     24  C   LIG    1        5.649  -0.309   0.768  0.00  0.00    +0.260 C 
ATOM     25  O   LIG    1        5.449  -0.612   1.940  0.00  0.00    -0.269 OA
ENDBRANCH   1  24
TORSDOF 2