REMARK  Name = BDB064273
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.079  -2.843   1.158  0.00  0.00    -0.268 N 
ATOM      2  H   LIG    1       -1.677  -3.595   1.697  0.00  0.00    +0.156 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -3.430  -2.686   1.404  0.00  0.00    +0.221 A 
ATOM      4  N   LIG    1       -4.139  -1.699   0.832  0.00  0.00    -0.211 NA
ATOM      5  C   LIG    1       -5.465  -1.598   1.111  0.00  0.00    +0.111 A 
ATOM      6  C   LIG    1       -6.082  -2.481   1.974  0.00  0.00    +0.167 A 
ATOM      7  F   LIG    1       -7.380  -2.407   2.297  0.00  0.00    -0.202 F 
ATOM      8  C   LIG    1       -5.285  -3.453   2.521  0.00  0.00    +0.155 A 
ATOM      9  N   LIG    1       -3.969  -3.574   2.255  0.00  0.00    -0.220 NA
BRANCH   5  10
ATOM     10  C   LIG    1       -6.165  -0.483   0.434  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1       -5.482   0.725   0.178  0.00  0.00    +0.027 A 
ATOM     12  C   LIG    1       -6.146   1.781  -0.472  0.00  0.00    +0.040 A 
ATOM     13  C   LIG    1       -7.476   1.674  -0.881  0.00  0.00    +0.078 A 
ATOM     14  N   LIG    1       -7.999   2.793  -1.507  0.00  0.00    -0.247 NA
ATOM     15  C   LIG    1       -7.078   3.727  -1.571  0.00  0.00    +0.157 A 
ATOM     16  C   LIG    1       -8.159   0.470  -0.632  0.00  0.00    +0.029 A 
ATOM     17  S   LIG    1       -5.552   3.342  -0.898  0.00  0.00    -0.075 S 
ATOM     18  C   LIG    1       -7.500  -0.587   0.015  0.00  0.00    +0.012 A 
ENDBRANCH   5  10
ENDBRANCH   1   3
BRANCH   1  22
ATOM     19  C   LIG    1        0.866  -1.011  -1.107  0.00  0.00    +0.055 A 
ATOM     20  C   LIG    1        1.091  -2.077  -0.256  0.00  0.00    +0.126 A 
ATOM     21  N   LIG    1        0.118  -2.660   0.489  0.00  0.00    -0.239 NA
ATOM     22  C   LIG    1       -1.149  -2.195   0.368  0.00  0.00    +0.125 A 
ATOM     23  C   LIG    1       -1.451  -1.149  -0.501  0.00  0.00    +0.044 A 
ATOM     24  C   LIG    1       -0.436  -0.552  -1.253  0.00  0.00    +0.018 A 
BRANCH  19  29
ATOM     25  N   LIG    1        5.638   0.521  -0.064  0.00  0.00    -0.297 NA
ATOM     26  C   LIG    1        5.280   1.297  -1.257  0.00  0.00    +0.103 C 
ATOM     27  C   LIG    1        4.162   0.602  -2.062  0.00  0.00    +0.123 C 
ATOM     28  N   LIG    1        3.058   0.108  -1.236  0.00  0.00    -0.295 N 
ATOM     29  C   LIG    1        1.961  -0.431  -1.896  0.00  0.00    +0.248 C 
ATOM     30  O   LIG    1        1.853  -0.461  -3.120  0.00  0.00    -0.270 OA
ATOM     31  C   LIG    1        3.093   0.517   0.170  0.00  0.00    +0.123 C 
ATOM     32  C   LIG    1        4.477   0.285   0.817  0.00  0.00    +0.103 C 
BRANCH  25  34
ATOM     33  C   LIG    1        8.103   0.605  -0.124  0.00  0.00    +0.024 C 
ATOM     34  C   LIG    1        6.837   0.959   0.665  0.00  0.00    +0.051 C 
ATOM     35  C   LIG    1        6.849   2.446   1.039  0.00  0.00    +0.024 C 
ENDBRANCH  25  34
ENDBRANCH  19  29
ENDBRANCH   1  22
TORSDOF 5