REMARK  Name = BDB033826
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.011  -0.321  -0.243  0.00  0.00    +0.079 A 
ATOM      2  C   LIG    1       -0.582   0.665  -1.218  0.00  0.00    +0.201 A 
ATOM      3  O   LIG    1        0.089   1.197  -2.096  0.00  0.00    -0.286 OA
ATOM      4  C   LIG    1       -2.008   0.994  -1.100  0.00  0.00    +0.068 A 
ATOM      5  C   LIG    1       -2.756   0.362  -0.118  0.00  0.00    +0.184 A 
ATOM      6  C   LIG    1       -4.109   0.672   0.008  0.00  0.00    +0.202 A 
ATOM      7  C   LIG    1       -4.707   1.582  -0.862  0.00  0.00    +0.162 A 
ATOM      8  C   LIG    1       -3.959   2.231  -1.834  0.00  0.00    +0.050 A 
ATOM      9  O   LIG    1       -2.216  -0.549   0.743  0.00  0.00    -0.446 OA
ATOM     10  C   LIG    1       -2.600   1.935  -1.956  0.00  0.00    +0.019 A 
ATOM     11  C   LIG    1       -0.866  -0.871   0.650  0.00  0.00    +0.220 A 
ENDROOT
BRANCH   1  15
ATOM     12  N   LIG    1        3.507  -0.931   0.147  0.00  0.00    -0.271 N 
ATOM     13  N   LIG    1        3.450  -1.095  -1.186  0.00  0.00    -0.179 NA
ATOM     14  C   LIG    1        2.166  -0.869  -1.478  0.00  0.00    +0.143 A 
ATOM     15  C   LIG    1        1.391  -0.601  -0.329  0.00  0.00    +0.027 A 
ATOM     16  C   LIG    1        2.298  -0.625   0.709  0.00  0.00    +0.117 A 
BRANCH  12  18
ATOM     17  C   LIG    1        5.603   0.183   0.805  0.00  0.00    +0.029 C 
ATOM     18  C   LIG    1        4.771  -1.087   0.840  0.00  0.00    +0.140 C 
ENDBRANCH  12  18
ENDBRANCH   1  15
BRANCH  11  19
ATOM     19  C   LIG    1       -0.479  -1.935   1.642  0.00  0.00    +0.451 C 
ATOM     20  F   LIG    1        0.088  -1.399   2.755  0.00  0.00    -0.163 F 
ATOM     21  F   LIG    1       -1.554  -2.651   2.069  0.00  0.00    -0.163 F 
ATOM     22  F   LIG    1        0.395  -2.847   1.147  0.00  0.00    -0.163 F 
ENDBRANCH  11  19
BRANCH   7  23
ATOM     23  O   LIG    1       -6.047   1.831  -0.791  0.00  0.00    -0.503 OA
ATOM     24  H   LIG    1       -6.479   0.980  -0.587  0.00  0.00    +0.292 HD
ENDBRANCH   7  23
BRANCH   6  25
ATOM     25  O   LIG    1       -4.855   0.103   1.005  0.00  0.00    -0.501 OA
ATOM     26  H   LIG    1       -5.462   0.795   1.328  0.00  0.00    +0.292 HD
ENDBRANCH   6  25
TORSDOF 5