REMARK  Name = BDB032374
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.295   2.125   0.514  0.00  0.00    +0.139 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1        0.960   1.423   0.471  0.00  0.00    +0.005 A 
ATOM      3  C   LIG    1        0.044   1.647   1.502  0.00  0.00    +0.128 A 
ATOM      4  F   LIG    1        0.375   2.455   2.521  0.00  0.00    -0.205 F 
ATOM      5  C   LIG    1       -1.217   1.055   1.504  0.00  0.00    +0.042 A 
ATOM      6  C   LIG    1       -1.598   0.215   0.452  0.00  0.00    -0.043 A 
ATOM      7  C   LIG    1       -0.698  -0.003  -0.599  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1        0.565   0.600  -0.592  0.00  0.00    +0.008 A 
BRANCH   6   9
ATOM      9  C   LIG    1       -2.968  -0.421   0.434  0.00  0.00    +0.050 C 
BRANCH   9  10
ATOM     10  C   LIG    1       -4.000   0.482  -0.264  0.00  0.00    +0.089 C 
BRANCH  10  11
ATOM     11  N   LIG    1       -5.333  -0.138  -0.329  0.00  0.00    -0.298 NA
ATOM     12  C   LIG    1       -6.046  -0.137   0.968  0.00  0.00    +0.112 C 
ATOM     13  C   LIG    1       -7.145   0.934   1.071  0.00  0.00    +0.175 C 
ATOM     14  O   LIG    1       -8.151   0.812   0.058  0.00  0.00    -0.377 OA
ATOM     15  C   LIG    1       -7.654   0.244  -1.162  0.00  0.00    +0.175 C 
ATOM     16  C   LIG    1       -6.157   0.512  -1.373  0.00  0.00    +0.112 C 
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   6   9
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  N   LIG    1        3.325   1.470  -0.295  0.00  0.00    -0.339 N 
ATOM     18  H   LIG    1        3.962   2.158  -0.688  0.00  0.00    +0.146 HD
BRANCH  17  22
ATOM     19  C   LIG    1        6.966  -1.726  -0.912  0.00  0.00    +0.124 A 
ATOM     20  C   LIG    1        5.881  -1.270  -0.130  0.00  0.00    +0.023 A 
ATOM     21  C   LIG    1        5.139  -0.156  -0.598  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        4.057   0.363   0.184  0.00  0.00    +0.035 A 
ATOM     23  C   LIG    1        3.696  -0.316   1.359  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1        4.413  -1.422   1.808  0.00  0.00    +0.003 A 
ATOM     25  C   LIG    1        5.510   0.380  -1.846  0.00  0.00    +0.030 A 
ATOM     26  C   LIG    1        6.576  -0.163  -2.542  0.00  0.00    +0.113 A 
ATOM     27  C   LIG    1        5.500  -1.886   1.078  0.00  0.00    +0.012 A 
ATOM     28  N   LIG    1        7.316  -1.193  -2.096  0.00  0.00    -0.240 NA
BRANCH  19  29
ATOM     29  N   LIG    1        7.771  -2.797  -0.507  0.00  0.00    -0.343 N 
ATOM     30  H   LIG    1        8.182  -2.607   0.399  0.00  0.00    +0.144 HD
ATOM     31  H   LIG    1        8.486  -2.893  -1.225  0.00  0.00    +0.144 HD
ENDBRANCH  19  29
ENDBRANCH  17  22
ENDBRANCH   1  17
TORSDOF 7