REMARK  Name = BDB063180
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.010   0.908   0.811  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   5
ATOM      2  N   LIG    1       -3.833  -0.600   1.335  0.00  0.00    -0.327 N 
ATOM      3  C   LIG    1       -3.732   0.758   0.768  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -2.330   1.307   1.011  0.00  0.00    +0.063 C 
ATOM      5  C   LIG    1       -1.264   0.362   0.450  0.00  0.00    +0.176 C 
ATOM      6  C   LIG    1       -1.444  -1.030   1.060  0.00  0.00    +0.063 C 
ATOM      7  C   LIG    1       -2.852  -1.549   0.788  0.00  0.00    +0.109 C 
BRANCH   2  10
ATOM      8  C   LIG    1       -7.349  -0.810   2.538  0.00  0.00    +0.122 A 
ATOM      9  C   LIG    1       -6.013  -0.426   2.374  0.00  0.00    +0.071 A 
ATOM     10  C   LIG    1       -5.170  -1.050   1.430  0.00  0.00    +0.069 A 
ATOM     11  C   LIG    1       -5.729  -2.091   0.666  0.00  0.00    +0.145 A 
ATOM     12  F   LIG    1       -5.005  -2.732  -0.265  0.00  0.00    -0.204 F 
ATOM     13  C   LIG    1       -7.058  -2.482   0.818  0.00  0.00    +0.044 A 
ATOM     14  C   LIG    1       -7.866  -1.839   1.752  0.00  0.00    +0.048 A 
BRANCH   8  16
ATOM     15  C   LIG    1       -7.754   0.759   4.279  0.00  0.00    +0.277 C 
ATOM     16  O   LIG    1       -8.240  -0.268   3.423  0.00  0.00    -0.495 OA
ENDBRANCH   8  16
ENDBRANCH   2  10
ENDBRANCH   1   5
BRANCH   1  17
ATOM     17  C   LIG    1        1.107   0.598   0.061  0.00  0.00    +0.121 A 
ATOM     18  C   LIG    1        2.286   1.210   0.479  0.00  0.00    +0.047 A 
ATOM     19  C   LIG    1        3.495   0.984  -0.194  0.00  0.00    +0.027 A 
ATOM     20  C   LIG    1        3.571   0.131  -1.301  0.00  0.00    +0.030 A 
ATOM     21  C   LIG    1        2.368  -0.468  -1.708  0.00  0.00    +0.027 A 
ATOM     22  C   LIG    1        1.153  -0.246  -1.041  0.00  0.00    +0.047 A 
BRANCH  20  23
ATOM     23  N   LIG    1        4.746  -0.104  -2.000  0.00  0.00    -0.326 N 
ATOM     24  C   LIG    1        6.010   0.623  -1.750  0.00  0.00    +0.084 C 
ATOM     25  C   LIG    1        7.056  -0.244  -2.474  0.00  0.00    +0.024 C 
ATOM     26  C   LIG    1        6.524  -1.650  -2.272  0.00  0.00    +0.021 C 
ATOM     27  C   LIG    1        5.020  -1.476  -2.457  0.00  0.00    +0.105 C 
BRANCH  24  28
ATOM     28  C   LIG    1        5.949   2.038  -2.329  0.00  0.00    +0.142 C 
BRANCH  28  29
ATOM     29  C   LIG    1        7.164   2.843  -1.953  0.00  0.00    +0.306 C 
ATOM     30  O   LIG    1        8.062   2.470  -1.216  0.00  0.00    -0.251 OA
BRANCH  29  31
ATOM     31  O   LIG    1        7.162   4.072  -2.521  0.00  0.00    -0.481 OA
ATOM     32  H   LIG    1        6.376   4.248  -3.074  0.00  0.00    +0.295 HD
ENDBRANCH  29  31
ENDBRANCH  28  29
ENDBRANCH  24  28
ENDBRANCH  20  23
ENDBRANCH   1  17
TORSDOF 8