REMARK  Name = BDB026927
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.099   1.039  -0.044  0.00  0.00    +0.156 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -0.243   2.511   0.146  0.00  0.00    -0.023 A 
ATOM      3  C   LIG    1       -0.879   3.256  -0.861  0.00  0.00    +0.005 A 
ATOM      4  C   LIG    1       -1.180   4.605  -0.665  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -0.839   5.231   0.532  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.189   4.512   1.532  0.00  0.00    +0.000 A 
ATOM      7  C   LIG    1        0.113   3.162   1.339  0.00  0.00    +0.005 A 
ENDBRANCH   1   2
BRANCH   1   8
ATOM      8  C   LIG    1       -1.085   0.244  -0.666  0.00  0.00    +0.186 C 
ATOM      9  O   LIG    1       -1.063  -0.059  -1.865  0.00  0.00    -0.290 OA
BRANCH   8  14
ATOM     10  C   LIG    1       -6.306  -1.911   2.119  0.00  0.00    +0.046 C 
ATOM     11  C   LIG    1       -5.394  -1.772   0.935  0.00  0.00    -0.027 A 
ATOM     12  C   LIG    1       -4.183  -1.053   0.941  0.00  0.00    +0.050 A 
ATOM     13  C   LIG    1       -3.354  -0.937  -0.179  0.00  0.00    +0.010 A 
ATOM     14  C   LIG    1       -2.215  -0.141   0.192  0.00  0.00    +0.044 A 
ATOM     15  C   LIG    1       -2.394   0.195   1.522  0.00  0.00    +0.095 A 
ATOM     16  C   LIG    1       -3.752  -1.572  -1.374  0.00  0.00    +0.011 A 
ATOM     17  C   LIG    1       -4.948  -2.292  -1.412  0.00  0.00    +0.001 A 
ATOM     18  N   LIG    1       -3.574  -0.349   1.954  0.00  0.00    -0.360 N 
ATOM     19  H   LIG    1       -3.952  -0.248   2.885  0.00  0.00    +0.165 HD
ATOM     20  C   LIG    1       -5.750  -2.387  -0.279  0.00  0.00    +0.005 A 
ENDBRANCH   8  14
ENDBRANCH   1   8
BRANCH   1  21
ATOM     21  N   LIG    1        1.303   0.935  -0.909  0.00  0.00    -0.300 NA
ATOM     22  H   LIG    1        0.973   0.776  -1.867  0.00  0.00    +0.123 HD
BRANCH  21  23
ATOM     23  C   LIG    1        2.250  -0.122  -0.520  0.00  0.00    +0.056 C 
ATOM     24  C   LIG    1        1.675  -1.528  -0.717  0.00  0.00    +0.024 C 
BRANCH  23  25
ATOM     25  C   LIG    1        3.540   0.085  -1.355  0.00  0.00    +0.055 C 
BRANCH  25  26
ATOM     26  C   LIG    1        4.725  -0.726  -0.869  0.00  0.00    -0.028 A 
ATOM     27  C   LIG    1        5.191  -1.884  -1.517  0.00  0.00    +0.046 A 
ATOM     28 CL   LIG    1        4.447  -2.499  -2.950  0.00  0.00    -0.083 Cl
ATOM     29  C   LIG    1        6.287  -2.591  -1.014  0.00  0.00    +0.040 A 
ATOM     30  C   LIG    1        6.927  -2.148   0.139  0.00  0.00    +0.042 A 
ATOM     31 CL   LIG    1        8.275  -3.020   0.758  0.00  0.00    -0.083 Cl
ATOM     32  C   LIG    1        6.486  -1.004   0.796  0.00  0.00    +0.020 A 
ATOM     33  C   LIG    1        5.391  -0.297   0.294  0.00  0.00    +0.006 A 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH  21  23
ENDBRANCH   1  21
TORSDOF 7