REMARK  Name = BDB064848
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.209  -1.353  -0.049  0.00  0.00    +0.020 A 
ATOM      2  C   LIG    1        0.071  -1.922  -0.108  0.00  0.00    +0.050 A 
ATOM      3  C   LIG    1        0.809  -2.115   1.060  0.00  0.00    +0.136 A 
ATOM      4  F   LIG    1        2.019  -2.685   0.966  0.00  0.00    -0.205 F 
ATOM      5  C   LIG    1        0.301  -1.723   2.292  0.00  0.00    +0.072 A 
ATOM      6  C   LIG    1       -0.990  -1.200   2.379  0.00  0.00    +0.016 A 
ATOM      7  C   LIG    1       -1.734  -1.009   1.210  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   1  13
ATOM      8  C   LIG    1       -4.924  -0.426  -3.183  0.00  0.00    +0.064 A 
ATOM      9  C   LIG    1       -3.677  -0.705  -2.589  0.00  0.00    +0.102 A 
ATOM     10  C   LIG    1       -2.561  -0.856  -3.404  0.00  0.00    +0.067 A 
ATOM     11  N   LIG    1       -1.532  -1.115  -2.535  0.00  0.00    -0.338 N 
ATOM     12  H   LIG    1       -0.569  -1.255  -2.799  0.00  0.00    +0.167 HD
ATOM     13  C   LIG    1       -2.023  -1.123  -1.248  0.00  0.00    +0.139 A 
ATOM     14  C   LIG    1       -2.600  -0.741  -4.796  0.00  0.00    +0.028 A 
ATOM     15  C   LIG    1       -3.843  -0.463  -5.372  0.00  0.00    +0.003 A 
ATOM     16  N   LIG    1       -3.319  -0.868  -1.262  0.00  0.00    -0.227 NA
ATOM     17  C   LIG    1       -4.986  -0.307  -4.584  0.00  0.00    +0.015 A 
BRANCH   8  21
ATOM     18  N   LIG    1       -6.058  -0.393  -1.030  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1       -5.169  -0.620  -0.591  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1       -6.889  -0.301  -0.464  0.00  0.00    +0.145 HD
ATOM     21  C   LIG    1       -6.160  -0.256  -2.384  0.00  0.00    +0.244 C 
ATOM     22  O   LIG    1       -7.237  -0.004  -2.913  0.00  0.00    -0.270 OA
ENDBRANCH   8  21
ENDBRANCH   1  13
BRANCH   5  23
ATOM     23  C   LIG    1        1.059  -1.965   3.518  0.00  0.00    +0.247 C 
ATOM     24  N   LIG    1        1.928  -1.032   4.018  0.00  0.00    -0.307 N 
ATOM     25  H   LIG    1        2.363  -1.373   4.869  0.00  0.00    +0.149 HD
ATOM     26  O   LIG    1        0.860  -3.010   4.131  0.00  0.00    -0.270 OA
BRANCH  24  27
ATOM     27  C   LIG    1        2.456   0.223   3.494  0.00  0.00    +0.092 C 
ATOM     28  C   LIG    1        3.372   0.128   2.258  0.00  0.00    +0.130 C 
ATOM     29  N   LIG    1        3.227   1.427   1.609  0.00  0.00    -0.300 N 
ATOM     30  C   LIG    1        2.293   2.288   2.323  0.00  0.00    +0.110 C 
ATOM     31  C   LIG    1        1.443   1.302   3.123  0.00  0.00    +0.043 C 
BRANCH  29  32
ATOM     32  C   LIG    1        4.147   1.921   0.758  0.00  0.00    +0.191 A 
ATOM     33  O   LIG    1        4.051   3.238   0.425  0.00  0.00    -0.430 OA
ATOM     34  C   LIG    1        5.065   3.517  -0.439  0.00  0.00    +0.196 A 
ATOM     35 CL   LIG    1        5.326   5.073  -1.118  0.00  0.00    -0.043 Cl
ATOM     36  C   LIG    1        5.812   2.383  -0.668  0.00  0.00    +0.064 A 
ATOM     37  C   LIG    1        5.218   1.353   0.102  0.00  0.00    +0.067 A 
ENDBRANCH  29  32
ENDBRANCH  24  27
ENDBRANCH   5  23
TORSDOF 5