REMARK  Name = BDB018190
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.647  -0.434  -0.233  0.00  0.00    +0.258 C 
ATOM      2  N   LIG    1       -0.941  -0.433   0.956  0.00  0.00    -0.252 N 
ATOM      3  H   LIG    1       -1.417  -0.648   1.827  0.00  0.00    +0.158 HD
ATOM      4  O   LIG    1       -1.160  -0.278  -1.349  0.00  0.00    -0.272 OA
ENDROOT
BRANCH   1   7
ATOM      5  N   LIG    1       -5.271  -0.430  -1.127  0.00  0.00    -0.266 N 
ATOM      6  C   LIG    1       -3.909  -1.056  -1.233  0.00  0.00    +0.166 C 
ATOM      7  C   LIG    1       -3.146  -0.576   0.000  0.00  0.00    +0.204 C 
ATOM      8  F   LIG    1       -3.404  -1.415   1.053  0.00  0.00    -0.230 F 
ATOM      9  C   LIG    1       -3.795   0.762   0.312  0.00  0.00    +0.071 C 
ATOM     10  C   LIG    1       -5.265   0.482   0.045  0.00  0.00    +0.120 C 
BRANCH   5  12
ATOM     11  N   LIG    1       -7.337  -1.423  -2.113  0.00  0.00    -0.174 NA
ATOM     12  C   LIG    1       -6.379  -0.960  -1.660  0.00  0.00    +0.169 C 
ENDBRANCH   5  12
ENDBRANCH   1   7
BRANCH   2  13
ATOM     13  C   LIG    1        0.416  -0.267   1.016  0.00  0.00    +0.225 A 
ATOM     14  O   LIG    1        0.971  -0.347   2.251  0.00  0.00    -0.339 OA
ATOM     15  N   LIG    1        2.333  -0.157   2.162  0.00  0.00    -0.076 NA
ATOM     16  C   LIG    1        2.609   0.038   0.859  0.00  0.00    +0.115 A 
ATOM     17  C   LIG    1        1.407  -0.024   0.101  0.00  0.00    +0.097 A 
BRANCH  16  18
ATOM     18  C   LIG    1        3.978   0.274   0.386  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        5.045   0.349   1.296  0.00  0.00    +0.010 A 
ATOM     20  C   LIG    1        6.352   0.574   0.854  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        6.612   0.729  -0.505  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        5.566   0.657  -1.422  0.00  0.00    +0.001 A 
ATOM     23  C   LIG    1        4.258   0.432  -0.980  0.00  0.00    +0.010 A 
ENDBRANCH  16  18
ENDBRANCH   2  13
TORSDOF 4