REMARK  Name = BDB025408
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.807  -1.859  -0.237  0.00  0.00    +0.128 A 
ATOM      2  N   LIG    1       -0.911  -0.807   0.013  0.00  0.00    -0.185 N 
ATOM      3  C   LIG    1        0.496  -0.878   0.114  0.00  0.00    +0.257 C 
ATOM      4  O   LIG    1        1.051  -1.971   0.025  0.00  0.00    -0.270 OA
ATOM      5  N   LIG    1       -1.574   0.383   0.180  0.00  0.00    -0.167 NA
ATOM      6  C   LIG    1       -2.859   0.055   0.059  0.00  0.00    +0.073 A 
ATOM      7  C   LIG    1       -3.989   1.010   0.186  0.00  0.00    +0.085 C 
ATOM      8  C   LIG    1       -5.241   0.381  -0.450  0.00  0.00    +0.166 C 
ATOM      9  O   LIG    1       -5.456  -0.960   0.034  0.00  0.00    -0.375 OA
ATOM     10  C   LIG    1       -4.422  -1.874  -0.397  0.00  0.00    +0.200 C 
ATOM     11  C   LIG    1       -3.065  -1.312  -0.195  0.00  0.00    +0.041 A 
ENDROOT
BRANCH   3  12
ATOM     12  C   LIG    1        1.187   0.456   0.365  0.00  0.00    +0.113 C 
ATOM     13  C   LIG    1        2.601   0.516  -0.208  0.00  0.00    -0.012 A 
ATOM     14  C   LIG    1        3.650   1.093   0.536  0.00  0.00    +0.031 A 
ATOM     15  C   LIG    1        4.947   1.103   0.001  0.00  0.00    +0.026 A 
ATOM     16  C   LIG    1        5.194   0.633  -1.289  0.00  0.00    +0.040 A 
ATOM     17  C   LIG    1        4.143   0.132  -2.041  0.00  0.00    +0.124 A 
ATOM     18  F   LIG    1        4.371  -0.306  -3.286  0.00  0.00    -0.205 F 
ATOM     19  N   LIG    1        3.462   1.542   1.852  0.00  0.00    -0.344 N 
ATOM     20  H   LIG    1        4.134   2.259   2.114  0.00  0.00    +0.146 HD
ATOM     21  C   LIG    1        2.094   1.867   2.220  0.00  0.00    +0.102 C 
ATOM     22  C   LIG    1        2.856   0.072  -1.519  0.00  0.00    +0.044 A 
ATOM     23  C   LIG    1        1.186   0.701   1.881  0.00  0.00    +0.036 C 
ENDBRANCH   3  12
BRANCH   1  24
ATOM     24  N   LIG    1       -1.414  -3.132  -0.475  0.00  0.00    -0.343 N 
ATOM     25  H   LIG    1       -0.433  -3.391  -0.313  0.00  0.00    +0.144 HD
ATOM     26  H   LIG    1       -2.053  -3.916  -0.374  0.00  0.00    +0.144 HD
ENDBRANCH   1  24
TORSDOF 2