REMARK  Name = BDB018290
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.278  -3.774   1.137  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -3.072  -2.417   0.654  0.00  0.00    -0.317 N 
ATOM      3  C   LIG    1       -4.098  -1.492   0.772  0.00  0.00    +0.255 A 
ATOM      4  O   LIG    1       -5.202  -1.717   1.259  0.00  0.00    -0.268 OA
ATOM      5  C   LIG    1       -3.804  -0.131   0.258  0.00  0.00    +0.116 A 
ATOM      6  C   LIG    1       -2.620   0.159  -0.306  0.00  0.00    +0.135 A 
ATOM      7  C   LIG    1       -1.581  -0.878  -0.429  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -1.861  -2.103   0.064  0.00  0.00    +0.101 A 
ENDROOT
BRANCH   7   9
ATOM      9  C   LIG    1       -0.311  -0.618  -1.049  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1        0.924  -1.030  -0.596  0.00  0.00    +0.117 A 
ATOM     11  N   LIG    1        1.841  -0.542  -1.488  0.00  0.00    -0.267 N 
ATOM     12  N   LIG    1        1.277   0.118  -2.523  0.00  0.00    -0.179 NA
ATOM     13  C   LIG    1       -0.029   0.084  -2.241  0.00  0.00    +0.143 A 
BRANCH  11  14
ATOM     14  C   LIG    1        3.287  -0.721  -1.439  0.00  0.00    +0.178 C 
BRANCH  14  15
ATOM     15  C   LIG    1        3.914   0.055  -0.307  0.00  0.00    -0.026 A 
ATOM     16  C   LIG    1        4.566  -0.610   0.741  0.00  0.00    +0.005 A 
ATOM     17  C   LIG    1        5.149   0.112   1.784  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        5.089   1.504   1.789  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1        4.448   2.177   0.751  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        3.865   1.458  -0.293  0.00  0.00    +0.005 A 
ENDBRANCH  14  15
ENDBRANCH  11  14
ENDBRANCH   7   9
BRANCH   6  21
ATOM     21  O   LIG    1       -2.242   1.391  -0.794  0.00  0.00    -0.482 OA
BRANCH  21  22
ATOM     22  C   LIG    1       -3.098   2.531  -0.657  0.00  0.00    +0.342 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -2.969   3.231   0.688  0.00  0.00    +0.424 C 
ATOM     24  F   LIG    1       -3.404   2.458   1.707  0.00  0.00    -0.167 F 
ATOM     25  F   LIG    1       -1.695   3.592   0.950  0.00  0.00    -0.167 F 
ATOM     26  F   LIG    1       -3.719   4.360   0.698  0.00  0.00    -0.167 F 
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH   6  21
TORSDOF 6