REMARK  Name = BDB064748
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.333   0.484  -0.751  0.00  0.00    +0.024 A 
ATOM      2  C   LIG    1       -2.338   1.224  -1.946  0.00  0.00    +0.125 A 
ATOM      3  C   LIG    1       -1.156   1.487  -2.642  0.00  0.00    +0.046 A 
ATOM      4  C   LIG    1        0.062   1.016  -2.148  0.00  0.00    +0.011 A 
ATOM      5  C   LIG    1        0.110   0.290  -0.954  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1       -1.089   0.021  -0.276  0.00  0.00    +0.020 A 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1       -5.880  -0.400   1.483  0.00  0.00    +0.117 A 
ATOM      8  C   LIG    1       -5.551   0.923   1.215  0.00  0.00    +0.046 A 
ATOM      9  C   LIG    1       -4.396   1.208   0.480  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1       -3.561   0.181   0.007  0.00  0.00    -0.014 A 
ATOM     11  C   LIG    1       -3.922  -1.147   0.294  0.00  0.00    +0.012 A 
ATOM     12  C   LIG    1       -5.075  -1.437   1.029  0.00  0.00    +0.046 A 
BRANCH   7  13
ATOM     13  O   LIG    1       -6.996  -0.726   2.195  0.00  0.00    -0.507 OA
ATOM     14  H   LIG    1       -7.465   0.094   2.422  0.00  0.00    +0.292 HD
ENDBRANCH   7  13
ENDBRANCH   1  10
BRANCH   2  15
ATOM     15  O   LIG    1       -3.525   1.685  -2.450  0.00  0.00    -0.506 OA
ATOM     16  H   LIG    1       -3.367   2.091  -3.317  0.00  0.00    +0.292 HD
ENDBRANCH   2  15
BRANCH   5  17
ATOM     17  C   LIG    1        1.366  -0.247  -0.411  0.00  0.00    +0.008 C 
ATOM     18  C   LIG    1        2.539   0.405  -0.449  0.00  0.00    +0.009 C 
BRANCH  18  19
ATOM     19  C   LIG    1        3.786  -0.143   0.103  0.00  0.00    -0.018 A 
ATOM     20  C   LIG    1        4.974   0.009  -0.625  0.00  0.00    +0.053 A 
ATOM     21  C   LIG    1        6.173  -0.480  -0.109  0.00  0.00    +0.121 A 
ATOM     22  C   LIG    1        6.213  -1.109   1.129  0.00  0.00    +0.090 A 
ATOM     23  C   LIG    1        5.038  -1.245   1.857  0.00  0.00    +0.121 A 
ATOM     24  C   LIG    1        3.828  -0.765   1.360  0.00  0.00    +0.053 A 
BRANCH  21  25
ATOM     25  O   LIG    1        7.345  -0.357  -0.798  0.00  0.00    -0.507 OA
ATOM     26  H   LIG    1        7.167   0.086  -1.643  0.00  0.00    +0.292 HD
ENDBRANCH  21  25
BRANCH  23  27
ATOM     27  O   LIG    1        5.112  -1.857   3.074  0.00  0.00    -0.507 OA
ATOM     28  H   LIG    1        4.226  -1.871   3.473  0.00  0.00    +0.292 HD
ENDBRANCH  23  27
ENDBRANCH  18  19
ENDBRANCH   5  17
TORSDOF 7