REMARK  Name = BDB024110
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.320  -0.668  -1.584  0.00  0.00    +0.171 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        1.094  -2.178  -1.608  0.00  0.00    -0.022 A 
ATOM      3  C   LIG    1        1.161  -2.933  -0.425  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1        0.942  -4.311  -0.451  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1        0.662  -4.950  -1.656  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1        0.606  -4.216  -2.839  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1        0.824  -2.837  -2.818  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1        0.629   0.870   0.216  0.00  0.00    -0.273 OA
ATOM      9  C   LIG    1        0.294   0.052  -0.638  0.00  0.00    +0.239 C 
ATOM     10  N   LIG    1       -1.026  -0.296  -0.924  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -1.157  -1.051  -1.587  0.00  0.00    +0.155 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -2.201   0.192  -0.317  0.00  0.00    +0.033 A 
ATOM     13  C   LIG    1       -3.411  -0.382  -0.718  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -4.629   0.048  -0.171  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -4.677   1.069   0.792  0.00  0.00    +0.002 A 
ATOM     16  C   LIG    1       -3.450   1.628   1.188  0.00  0.00    +0.012 A 
ATOM     17  C   LIG    1       -2.230   1.201   0.641  0.00  0.00    +0.024 A 
BRANCH  15  18
ATOM     18  C   LIG    1       -5.947   1.540   1.379  0.00  0.00    +0.093 A 
ATOM     19  N   LIG    1       -5.889   1.994   2.654  0.00  0.00    -0.149 NA
ATOM     20  N   LIG    1       -7.014   2.455   3.289  0.00  0.00    -0.157 NA
ATOM     21  C   LIG    1       -8.188   2.458   2.634  0.00  0.00    +0.135 A 
ATOM     22  C   LIG    1       -8.303   2.014   1.334  0.00  0.00    +0.024 A 
ATOM     23  C   LIG    1       -7.159   1.547   0.694  0.00  0.00    +0.032 A 
ENDBRANCH  15  18
ENDBRANCH  10  12
ENDBRANCH   1   9
BRANCH   1  24
ATOM     24  N   LIG    1        2.726  -0.399  -1.214  0.00  0.00    -0.302 NA
ATOM     25  H   LIG    1        3.328  -1.079  -1.676  0.00  0.00    +0.123 HD
BRANCH  24  26
ATOM     26  C   LIG    1        3.160   0.955  -1.571  0.00  0.00    +0.086 C 
BRANCH  26  27
ATOM     27  C   LIG    1        4.648   1.188  -1.243  0.00  0.00    +0.050 C 
BRANCH  27  28
ATOM     28  C   LIG    1        5.085   1.158   0.207  0.00  0.00    -0.046 A 
ATOM     29  C   LIG    1        4.189   1.195   1.284  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1        4.654   1.187   2.603  0.00  0.00    +0.020 A 
ATOM     31  C   LIG    1        6.021   1.151   2.857  0.00  0.00    +0.041 A 
ATOM     32 CL   LIG    1        6.593   1.141   4.480  0.00  0.00    -0.084 Cl
ATOM     33  C   LIG    1        6.930   1.124   1.803  0.00  0.00    +0.020 A 
ATOM     34  C   LIG    1        6.463   1.131   0.486  0.00  0.00    +0.005 A 
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  24  26
ENDBRANCH   1  24
TORSDOF 8