REMARK  Name = BDB058157
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.447   0.276   0.400  0.00  0.00    +0.142 A 
ATOM      2  N   LIG    1       -1.910   1.360   1.112  0.00  0.00    -0.306 N 
ATOM      3  H   LIG    1       -1.277   2.015   1.546  0.00  0.00    +0.170 HD
ATOM      4  C   LIG    1       -3.236   1.580   1.379  0.00  0.00    +0.260 A 
ATOM      5  O   LIG    1       -3.618   2.534   2.046  0.00  0.00    -0.267 OA
ATOM      6  C   LIG    1       -4.173   0.594   0.821  0.00  0.00    +0.070 A 
ATOM      7  C   LIG    1       -3.630  -0.478   0.108  0.00  0.00    +0.114 A 
ATOM      8  C   LIG    1       -4.518  -1.423  -0.420  0.00  0.00    +0.152 A 
ATOM      9  C   LIG    1       -5.895  -1.307  -0.247  0.00  0.00    +0.079 A 
ATOM     10  C   LIG    1       -6.398  -0.228   0.468  0.00  0.00    +0.127 A 
ATOM     11  F   LIG    1       -7.720  -0.111   0.638  0.00  0.00    -0.205 F 
ATOM     12  F   LIG    1       -4.050  -2.474  -1.112  0.00  0.00    -0.203 F 
ATOM     13  C   LIG    1       -5.552   0.730   1.008  0.00  0.00    +0.054 A 
ATOM     14  N   LIG    1       -2.243  -0.623  -0.084  0.00  0.00    -0.226 NA
ENDROOT
BRANCH   1  18
ATOM     15  C   LIG    1        2.821  -0.127  -0.135  0.00  0.00    -0.017 A 
ATOM     16  C   LIG    1        2.238   1.142   0.008  0.00  0.00    +0.007 A 
ATOM     17  C   LIG    1        0.855   1.289   0.179  0.00  0.00    +0.012 A 
ATOM     18  C   LIG    1        0.025   0.164   0.221  0.00  0.00    +0.017 A 
ATOM     19  C   LIG    1        0.589  -1.105   0.072  0.00  0.00    +0.012 A 
ATOM     20  C   LIG    1        1.969  -1.247  -0.096  0.00  0.00    +0.007 A 
BRANCH  15  22
ATOM     21  C   LIG    1        5.101   0.914  -0.753  0.00  0.00    +0.046 C 
ATOM     22  C   LIG    1        4.325  -0.335  -0.314  0.00  0.00    +0.085 C 
ATOM     23  C   LIG    1        4.943  -0.890   0.974  0.00  0.00    +0.046 C 
BRANCH  22  24
ATOM     24  O   LIG    1        4.536  -1.308  -1.346  0.00  0.00    -0.385 OA
ATOM     25  H   LIG    1        3.904  -1.111  -2.059  0.00  0.00    +0.211 HD
ENDBRANCH  22  24
ENDBRANCH  15  22
ENDBRANCH   1  18
TORSDOF 3