REMARK  Name = BDB026884
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.447   1.261   0.282  0.00  0.00    +0.158 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.385   2.453   0.130  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.667   2.996  -1.135  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -2.536   4.080  -1.265  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -3.136   4.633  -0.136  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -2.870   4.101   1.125  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -2.001   3.016   1.258  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -0.941  -0.355  -1.488  0.00  0.00    -0.288 OA
ATOM      9  C   LIG    1       -1.107  -0.015  -0.312  0.00  0.00    +0.205 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -1.968  -0.805   0.587  0.00  0.00    +0.137 A 
ATOM     11  C   LIG    1       -2.750  -1.949   0.236  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1       -3.377  -2.339   1.414  0.00  0.00    +0.066 A 
ATOM     13  C   LIG    1       -4.244  -3.433   1.496  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1       -4.474  -4.154   0.320  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.862  -3.790  -0.879  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -2.952  -1.447   2.357  0.00  0.00    -0.276 N 
ATOM     17  H   LIG    1       -3.210  -1.423   3.337  0.00  0.00    +0.189 HD
ATOM     18  C   LIG    1       -2.998  -2.690  -0.937  0.00  0.00    +0.012 A 
ATOM     19  N   LIG    1       -2.097  -0.518   1.898  0.00  0.00    -0.170 NA
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        0.863   1.566  -0.366  0.00  0.00    -0.303 NA
ATOM     21  H   LIG    1        1.161   2.487  -0.046  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.887   0.575  -0.023  0.00  0.00    +0.086 C 
BRANCH  22  23
ATOM     23  C   LIG    1        3.207   0.912  -0.729  0.00  0.00    +0.050 C 
BRANCH  23  24
ATOM     24  C   LIG    1        4.290  -0.086  -0.393  0.00  0.00    -0.046 A 
ATOM     25  C   LIG    1        5.186   0.161   0.657  0.00  0.00    +0.005 A 
ATOM     26  C   LIG    1        6.173  -0.773   0.977  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        6.265  -1.960   0.252  0.00  0.00    +0.041 A 
ATOM     28 CL   LIG    1        7.481  -3.111   0.649  0.00  0.00    -0.084 Cl
ATOM     29  C   LIG    1        5.378  -2.221  -0.789  0.00  0.00    +0.020 A 
ATOM     30  C   LIG    1        4.391  -1.287  -1.110  0.00  0.00    +0.005 A 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7