REMARK  Name = BDB026802
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.341   1.272  -0.235  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.225   2.494  -0.017  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -1.000   3.325   1.094  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.792   4.453   1.313  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -2.811   4.775   0.420  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -3.033   3.974  -0.698  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -2.241   2.845  -0.921  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      8  O   LIG    1       -1.171  -0.245  -1.937  0.00  0.00    -0.290 OA
ATOM      9  C   LIG    1       -1.154   0.045  -0.736  0.00  0.00    +0.186 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -1.900  -0.757   0.245  0.00  0.00    +0.044 A 
ATOM     11  C   LIG    1       -2.603  -1.987   0.002  0.00  0.00    +0.010 A 
ATOM     12  C   LIG    1       -3.167  -2.399   1.211  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -3.925  -3.570   1.337  0.00  0.00    +0.026 A 
ATOM     14  C   LIG    1       -4.115  -4.348   0.192  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1       -3.567  -3.967  -1.030  0.00  0.00    +0.001 A 
ATOM     16  N   LIG    1       -2.832  -1.460   2.155  0.00  0.00    -0.360 N 
ATOM     17  H   LIG    1       -3.118  -1.497   3.124  0.00  0.00    +0.165 HD
ATOM     18  C   LIG    1       -2.813  -2.794  -1.137  0.00  0.00    +0.011 A 
ATOM     19  C   LIG    1       -2.067  -0.473   1.591  0.00  0.00    +0.095 A 
ENDBRANCH   9  10
ENDBRANCH   1   9
BRANCH   1  20
ATOM     20  N   LIG    1        0.742   1.624  -1.195  0.00  0.00    -0.303 NA
ATOM     21  H   LIG    1        0.308   1.610  -2.123  0.00  0.00    +0.123 HD
BRANCH  20  22
ATOM     22  C   LIG    1        1.851   0.662  -1.198  0.00  0.00    +0.086 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.805   0.852  -0.010  0.00  0.00    +0.050 C 
BRANCH  23  24
ATOM     24  C   LIG    1        3.976  -0.101  -0.079  0.00  0.00    -0.046 A 
ATOM     25  C   LIG    1        3.863  -1.403   0.429  0.00  0.00    +0.005 A 
ATOM     26  C   LIG    1        4.940  -2.288   0.349  0.00  0.00    +0.020 A 
ATOM     27  C   LIG    1        6.133  -1.877  -0.243  0.00  0.00    +0.041 A 
ATOM     28 CL   LIG    1        7.459  -2.968  -0.341  0.00  0.00    -0.084 Cl
ATOM     29  C   LIG    1        6.257  -0.588  -0.757  0.00  0.00    +0.020 A 
ATOM     30  C   LIG    1        5.180   0.298  -0.678  0.00  0.00    +0.005 A 
ENDBRANCH  23  24
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   1  20
TORSDOF 7