REMARK  Name = BDB011210
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.259   1.042   0.712  0.00  0.00    +0.055 A 
ATOM      2  N   LIG    1       -1.536  -0.129   0.439  0.00  0.00    -0.339 N 
ATOM      3  C   LIG    1       -0.226   0.141   0.707  0.00  0.00    +0.057 A 
ATOM      4  C   LIG    1        1.077  -0.578   0.687  0.00  0.00    +0.159 C 
ATOM      5  N   LIG    1        1.962   0.504   1.217  0.00  0.00    -0.254 N 
ATOM      6  C   LIG    1        1.256   1.680   1.555  0.00  0.00    +0.253 C 
ATOM      7  O   LIG    1        1.642   2.704   2.093  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -0.109   1.411   1.194  0.00  0.00    +0.061 A 
ATOM      9  C   LIG    1       -1.370   1.999   1.199  0.00  0.00    +0.041 A 
ENDROOT
BRANCH   5  10
ATOM     10  C   LIG    1        3.348   0.297   1.467  0.00  0.00    +0.042 A 
ATOM     11  C   LIG    1        4.331   1.278   1.210  0.00  0.00    -0.029 A 
ATOM     12  C   LIG    1        4.053   2.600   0.544  0.00  0.00    +0.045 C 
ATOM     13  C   LIG    1        5.677   1.012   1.538  0.00  0.00    +0.006 A 
ATOM     14  C   LIG    1        6.063  -0.220   2.060  0.00  0.00    +0.020 A 
ATOM     15  C   LIG    1        5.103  -1.200   2.263  0.00  0.00    +0.043 A 
ATOM     16 CL   LIG    1        5.565  -2.733   2.894  0.00  0.00    -0.083 Cl
ATOM     17  C   LIG    1        3.762  -0.950   1.970  0.00  0.00    +0.043 A 
ENDBRANCH   5  10
BRANCH   4  18
ATOM     18  C   LIG    1        1.527  -1.043  -0.686  0.00  0.00    -0.021 A 
ATOM     19  C   LIG    1        1.543  -0.172  -1.792  0.00  0.00    +0.007 A 
ATOM     20  C   LIG    1        1.980  -0.613  -3.043  0.00  0.00    +0.020 A 
ATOM     21  C   LIG    1        2.414  -1.926  -3.200  0.00  0.00    +0.041 A 
ATOM     22 CL   LIG    1        2.951  -2.470  -4.741  0.00  0.00    -0.084 Cl
ATOM     23  C   LIG    1        2.417  -2.802  -2.118  0.00  0.00    +0.020 A 
ATOM     24  C   LIG    1        1.978  -2.362  -0.866  0.00  0.00    +0.007 A 
ENDBRANCH   4  18
BRANCH   1  26
ATOM     25  C   LIG    1       -4.340   1.305  -0.691  0.00  0.00    +0.224 A 
ATOM     26  C   LIG    1       -3.710   1.189   0.554  0.00  0.00    +0.060 A 
ATOM     27  C   LIG    1       -4.520   1.236   1.692  0.00  0.00    +0.017 A 
ATOM     28  C   LIG    1       -5.899   1.375   1.557  0.00  0.00    +0.021 A 
ATOM     29  C   LIG    1       -6.425   1.465   0.280  0.00  0.00    +0.114 A 
ATOM     30  N   LIG    1       -5.681   1.430  -0.846  0.00  0.00    -0.221 NA
BRANCH  25  32
ATOM     31  C   LIG    1       -4.260   1.489  -3.028  0.00  0.00    +0.279 C 
ATOM     32  O   LIG    1       -3.541   1.280  -1.819  0.00  0.00    -0.479 OA
ENDBRANCH  25  32
ENDBRANCH   1  26
BRANCH   2  33
ATOM     33  C   LIG    1       -2.130  -1.406   0.035  0.00  0.00    +0.081 C 
ATOM     34  C   LIG    1       -1.880  -1.744  -1.433  0.00  0.00    +0.030 C 
ATOM     35  C   LIG    1       -1.734  -2.564   0.953  0.00  0.00    +0.030 C 
ENDBRANCH   2  33
TORSDOF 5