REMARK  Name = BDB031079
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.940  -1.768   0.741  0.00  0.00    +0.133 A 
ATOM      2  C   LIG    1       -3.413  -0.545   0.078  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1       -2.075  -0.460  -0.097  0.00  0.00    +0.105 A 
ATOM      4  N   LIG    1       -1.230  -1.476   0.346  0.00  0.00    -0.297 N 
ATOM      5  C   LIG    1       -1.696  -2.603   1.010  0.00  0.00    +0.142 A 
ATOM      6  N   LIG    1       -0.714  -3.392   1.388  0.00  0.00    -0.235 NA
ATOM      7  C   LIG    1        0.427  -2.764   0.963  0.00  0.00    +0.141 A 
ATOM      8  C   LIG    1        0.147  -1.601   0.269  0.00  0.00    +0.091 A 
ATOM      9  C   LIG    1       -3.099  -2.732   1.182  0.00  0.00    +0.093 A 
ENDROOT
BRANCH   2  10
ATOM     10  C   LIG    1       -4.265   0.521  -0.365  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1       -5.269   1.132   0.353  0.00  0.00    +0.116 A 
ATOM     12  N   LIG    1       -5.787   2.094  -0.463  0.00  0.00    -0.274 N 
ATOM     13  C   LIG    1       -6.873   2.994  -0.162  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1       -5.176   2.169  -1.661  0.00  0.00    -0.179 NA
ATOM     15  C   LIG    1       -4.253   1.205  -1.601  0.00  0.00    +0.143 A 
ENDBRANCH   2  10
BRANCH   8  16
ATOM     16  C   LIG    1        1.058  -0.669  -0.368  0.00  0.00    +0.091 A 
ATOM     17  N   LIG    1        2.058  -0.241   0.434  0.00  0.00    -0.231 NA
ATOM     18  C   LIG    1        2.959   0.612  -0.085  0.00  0.00    +0.120 A 
ATOM     19  C   LIG    1        2.881   1.071  -1.393  0.00  0.00    +0.043 A 
ATOM     20  C   LIG    1        1.854   0.610  -2.212  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1        0.926  -0.284  -1.695  0.00  0.00    +0.030 A 
BRANCH  18  22
ATOM     22  N   LIG    1        3.959   1.029   0.801  0.00  0.00    -0.322 N 
ATOM     23  H   LIG    1        3.661   0.560   1.663  0.00  0.00    +0.148 HD
BRANCH  22  24
ATOM     24  C   LIG    1        5.307   0.542   0.445  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1        6.200   0.458   1.687  0.00  0.00    +0.201 C 
ATOM     26  F   LIG    1        6.114  -0.776   2.245  0.00  0.00    -0.242 F 
ATOM     27  C   LIG    1        7.614   0.732   1.181  0.00  0.00    +0.119 C 
ATOM     28  N   LIG    1        7.501   1.151  -0.223  0.00  0.00    -0.311 NA
ATOM     29  H   LIG    1        8.123   1.933  -0.424  0.00  0.00    +0.122 HD
ATOM     30  C   LIG    1        6.097   1.533  -0.412  0.00  0.00    +0.106 C 
ENDBRANCH  22  24
ENDBRANCH  18  22
ENDBRANCH   8  16
BRANCH   1  32
ATOM     31  C   LIG    1       -5.919  -2.954   1.421  0.00  0.00    +0.277 C 
ATOM     32  O   LIG    1       -5.317  -1.810   0.828  0.00  0.00    -0.494 OA
ENDBRANCH   1  32
TORSDOF 5