REMARK  Name = BDB026910
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.459   0.685  -1.455  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.652   2.005  -0.720  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -0.937   3.171  -1.452  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.130   4.392  -0.802  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -1.051   4.463   0.587  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.784   3.314   1.328  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1       -0.590   2.092   0.681  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  C   LIG    1        0.583  -0.272  -0.798  0.00  0.00    +0.186 C 
ATOM      9  O   LIG    1        0.250  -1.307  -0.216  0.00  0.00    -0.290 OA
BRANCH   8  14
ATOM     10  C   LIG    1        5.675  -1.590   0.415  0.00  0.00    +0.122 A 
ATOM     11  C   LIG    1        5.572  -0.376  -0.273  0.00  0.00    +0.071 A 
ATOM     12  C   LIG    1        4.290   0.064  -0.642  0.00  0.00    +0.051 A 
ATOM     13  C   LIG    1        3.126  -0.650  -0.355  0.00  0.00    +0.010 A 
ATOM     14  C   LIG    1        2.012   0.095  -0.876  0.00  0.00    +0.044 A 
ATOM     15  C   LIG    1        2.549   1.230  -1.463  0.00  0.00    +0.095 A 
ATOM     16  C   LIG    1        3.256  -1.871   0.339  0.00  0.00    +0.014 A 
ATOM     17  N   LIG    1        3.909   1.200  -1.312  0.00  0.00    -0.360 N 
ATOM     18  H   LIG    1        4.548   1.912  -1.641  0.00  0.00    +0.165 HD
ATOM     19  C   LIG    1        4.527  -2.324   0.714  0.00  0.00    +0.046 A 
BRANCH  10  21
ATOM     20  C   LIG    1        8.046  -1.464   0.572  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1        6.841  -2.165   0.848  0.00  0.00    -0.495 OA
ENDBRANCH  10  21
ENDBRANCH   8  14
ENDBRANCH   1   8
BRANCH   1  22
ATOM     22  N   LIG    1       -1.747   0.014  -1.787  0.00  0.00    -0.303 NA
ATOM     23  H   LIG    1       -2.269   0.621  -2.416  0.00  0.00    +0.123 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -2.599  -0.287  -0.629  0.00  0.00    +0.086 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -3.751  -1.206  -1.059  0.00  0.00    +0.050 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -4.668  -1.532   0.097  0.00  0.00    -0.046 A 
ATOM     27  C   LIG    1       -4.340  -2.565   0.987  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -5.174  -2.858   2.068  0.00  0.00    +0.020 A 
ATOM     29  C   LIG    1       -6.337  -2.117   2.265  0.00  0.00    +0.041 A 
ATOM     30 CL   LIG    1       -7.365  -2.477   3.597  0.00  0.00    -0.084 Cl
ATOM     31  C   LIG    1       -6.672  -1.085   1.392  0.00  0.00    +0.020 A 
ATOM     32  C   LIG    1       -5.838  -0.791   0.311  0.00  0.00    +0.005 A 
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  22  24
ENDBRANCH   1  22
TORSDOF 8