REMARK  Name = BDB065006
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.584  -0.168   0.521  0.00  0.00    -0.026 A 
ATOM      2  C   LIG    1        0.202  -1.206   1.040  0.00  0.00    +0.006 A 
ATOM      3  C   LIG    1        1.591  -1.204   0.868  0.00  0.00    +0.009 A 
ATOM      4  C   LIG    1        2.236  -0.168   0.173  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1        1.443   0.868  -0.345  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1        0.055   0.869  -0.175  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   1  16
ATOM      7  O   LIG    1       -5.931   0.207   2.422  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -4.965   0.358   1.672  0.00  0.00    +0.246 C 
ATOM      9  C   LIG    1       -5.120   0.162   0.196  0.00  0.00    +0.057 A 
ATOM     10  C   LIG    1       -4.112  -0.068  -0.763  0.00  0.00    +0.040 A 
ATOM     11  C   LIG    1       -4.520  -0.187  -2.116  0.00  0.00    +0.024 A 
ATOM     12  C   LIG    1       -5.857  -0.149  -2.513  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1       -6.842   0.034  -1.561  0.00  0.00    +0.001 A 
ATOM     14  N   LIG    1       -2.728  -0.076  -0.584  0.00  0.00    -0.335 N 
ATOM     15  H   LIG    1       -2.255  -0.653  -1.276  0.00  0.00    +0.147 HD
ATOM     16  C   LIG    1       -2.093  -0.176   0.723  0.00  0.00    +0.118 C 
ATOM     17  C   LIG    1       -2.523   0.990   1.620  0.00  0.00    +0.131 C 
ATOM     18  C   LIG    1       -6.474   0.190  -0.226  0.00  0.00    +0.015 A 
ATOM     19  N   LIG    1       -3.789   0.725   2.259  0.00  0.00    -0.309 N 
ATOM     20  H   LIG    1       -3.875   0.883   3.255  0.00  0.00    +0.149 HD
ENDBRANCH   1  16
BRANCH   4  21
ATOM     21  C   LIG    1        3.697  -0.169  -0.006  0.00  0.00    -0.018 A 
ATOM     22  C   LIG    1        4.473   0.938   0.372  0.00  0.00    +0.009 A 
ATOM     23  C   LIG    1        5.862   0.939   0.203  0.00  0.00    +0.013 A 
ATOM     24  C   LIG    1        6.514  -0.174  -0.346  0.00  0.00    +0.055 A 
ATOM     25  C   LIG    1        5.745  -1.279  -0.735  0.00  0.00    +0.013 A 
ATOM     26  C   LIG    1        4.357  -1.276  -0.563  0.00  0.00    +0.009 A 
BRANCH  24  27
ATOM     27  C   LIG    1        8.008  -0.166  -0.552  0.00  0.00    +0.417 C 
ATOM     28  F   LIG    1        8.671   0.592   0.367  0.00  0.00    -0.166 F 
ATOM     29  F   LIG    1        8.565  -1.407  -0.478  0.00  0.00    -0.166 F 
ATOM     30  F   LIG    1        8.361   0.331  -1.769  0.00  0.00    -0.166 F 
ENDBRANCH  24  27
ENDBRANCH   4  21
TORSDOF 3