REMARK  Name = BDB063240
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.351   0.054  -0.874  0.00  0.00    +0.163 A 
ATOM      2  N   LIG    1       -0.350   0.090   0.041  0.00  0.00    -0.194 NA
ATOM      3  C   LIG    1        0.907  -0.067  -0.408  0.00  0.00    +0.241 A 
ATOM      4  N   LIG    1        1.179  -0.273  -1.712  0.00  0.00    -0.113 NA
ATOM      5  N   LIG    1        0.174  -0.342  -2.628  0.00  0.00    -0.151 NA
ATOM      6  C   LIG    1       -1.088  -0.184  -2.201  0.00  0.00    +0.181 A 
ENDROOT
BRANCH   1   8
ATOM      7  C   LIG    1       -3.799   0.735  -1.097  0.00  0.00    +0.116 A 
ATOM      8  N   LIG    1       -2.691   0.224  -0.414  0.00  0.00    -0.279 N 
ATOM      9  C   LIG    1       -3.141  -0.096   0.869  0.00  0.00    +0.075 A 
ATOM     10  C   LIG    1       -4.511   0.142   0.837  0.00  0.00    +0.090 A 
ATOM     11  C   LIG    1       -5.297  -0.117   1.970  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1       -4.684  -0.620   3.122  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1       -3.314  -0.866   3.141  0.00  0.00    +0.002 A 
ATOM     14  C   LIG    1       -2.517  -0.616   2.017  0.00  0.00    +0.028 A 
ATOM     15  N   LIG    1       -4.898   0.630  -0.375  0.00  0.00    -0.232 NA
BRANCH   7  17
ATOM     16  C   LIG    1       -4.496   0.664  -3.496  0.00  0.00    +0.012 C 
ATOM     17  C   LIG    1       -3.790   1.460  -2.408  0.00  0.00    +0.071 C 
ENDBRANCH   7  17
ENDBRANCH   1   8
BRANCH   3  18
ATOM     18  N   LIG    1        1.895   0.005   0.571  0.00  0.00    -0.282 N 
ATOM     19  H   LIG    1        1.465   0.192   1.464  0.00  0.00    +0.155 HD
BRANCH  18  20
ATOM     20  C   LIG    1        3.289  -0.104   0.550  0.00  0.00    +0.034 A 
ATOM     21  C   LIG    1        4.037  -0.370  -0.601  0.00  0.00    +0.024 A 
ATOM     22  C   LIG    1        5.434  -0.468  -0.555  0.00  0.00    +0.014 A 
ATOM     23  C   LIG    1        6.125  -0.308   0.651  0.00  0.00    +0.055 A 
ATOM     24  C   LIG    1        5.387  -0.033   1.808  0.00  0.00    +0.014 A 
ATOM     25  C   LIG    1        3.992   0.063   1.754  0.00  0.00    +0.024 A 
BRANCH  23  26
ATOM     26  C   LIG    1        7.630  -0.390   0.697  0.00  0.00    +0.417 C 
ATOM     27  F   LIG    1        8.221   0.822   0.509  0.00  0.00    -0.166 F 
ATOM     28  F   LIG    1        8.152  -1.214  -0.254  0.00  0.00    -0.166 F 
ATOM     29  F   LIG    1        8.102  -0.855   1.888  0.00  0.00    -0.166 F 
ENDBRANCH  23  26
ENDBRANCH  18  20
ENDBRANCH   3  18
TORSDOF 5