REMARK  Name = BDB018088
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.608  -0.253   1.924  0.00  0.00    +0.002 C 
ATOM      2  C   LIG    1       -1.829  -1.631   2.551  0.00  0.00    +0.008 C 
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -2.878   0.623   1.976  0.00  0.00    +0.078 C 
BRANCH   3  11
ATOM      4  C   LIG    1       -4.823   0.253  -2.711  0.00  0.00    +0.046 C 
ATOM      5  C   LIG    1       -5.751  -0.495  -1.795  0.00  0.00    -0.022 A 
ATOM      6  C   LIG    1       -5.486  -0.571  -0.415  0.00  0.00    +0.081 A 
ATOM      7  C   LIG    1       -6.375  -1.277   0.408  0.00  0.00    +0.068 A 
ATOM      8  C   LIG    1       -6.067  -1.340   1.846  0.00  0.00    +0.259 A 
ATOM      9  N   LIG    1       -4.925  -0.692   2.239  0.00  0.00    -0.310 N 
ATOM     10  H   LIG    1       -4.719  -0.732   3.226  0.00  0.00    +0.170 HD
ATOM     11  C   LIG    1       -4.108  -0.021   1.371  0.00  0.00    +0.111 A 
ATOM     12  O   LIG    1       -6.782  -1.936   2.642  0.00  0.00    -0.267 OA
ATOM     13  C   LIG    1       -7.512  -1.902  -0.105  0.00  0.00    +0.053 A 
ATOM     14  C   LIG    1       -7.758  -1.816  -1.466  0.00  0.00    +0.125 A 
ATOM     15  F   LIG    1       -8.844  -2.409  -1.979  0.00  0.00    -0.205 F 
ATOM     16  N   LIG    1       -4.339   0.057   0.103  0.00  0.00    -0.233 NA
ATOM     17  C   LIG    1       -6.895  -1.123  -2.312  0.00  0.00    +0.043 A 
ENDBRANCH   3  11
ENDBRANCH   1   3
BRANCH   1  18
ATOM     18  C   LIG    1       -1.034  -0.397   0.503  0.00  0.00    +0.099 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -0.273   0.850   0.075  0.00  0.00    +0.216 C 
ATOM     20  N   LIG    1        1.080   0.931   0.387  0.00  0.00    -0.301 N 
ATOM     21  C   LIG    1        1.827   2.104  -0.060  0.00  0.00    +0.108 C 
ATOM     22  C   LIG    1        3.222   1.727  -0.543  0.00  0.00    +0.030 C 
ATOM     23  C   LIG    1        4.043   1.011   0.540  0.00  0.00    +0.063 C 
ATOM     24  C   LIG    1        3.157   0.394   1.636  0.00  0.00    +0.030 C 
ATOM     25  C   LIG    1        1.833  -0.119   1.076  0.00  0.00    +0.108 C 
ATOM     26  O   LIG    1       -0.867   1.763  -0.500  0.00  0.00    -0.276 OA
BRANCH  23  27
ATOM     27  C   LIG    1        4.926  -0.058  -0.111  0.00  0.00    +0.169 C 
ATOM     28  O   LIG    1        4.590  -1.242  -0.105  0.00  0.00    -0.292 OA
BRANCH  27  29
ATOM     29  C   LIG    1        6.165   0.359  -0.757  0.00  0.00    +0.055 A 
ATOM     30  C   LIG    1        7.054  -0.474  -1.412  0.00  0.00    +0.119 A 
ATOM     31  N   LIG    1        8.066   0.316  -1.866  0.00  0.00    -0.274 N 
ATOM     32  C   LIG    1        9.228  -0.100  -2.614  0.00  0.00    +0.172 C 
ATOM     33  N   LIG    1        7.908   1.614  -1.552  0.00  0.00    -0.179 NA
ATOM     34  C   LIG    1        6.754   1.637  -0.881  0.00  0.00    +0.145 A 
ENDBRANCH  27  29
ENDBRANCH  23  27
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 6