REMARK  Name = BDB065206
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.276   0.243   0.451  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1        1.693   0.011  -0.795  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        0.321   0.219  -0.974  0.00  0.00    +0.012 A 
ATOM      4  C   LIG    1       -0.490   0.648   0.087  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        0.105   0.864   1.336  0.00  0.00    +0.012 A 
ATOM      6  C   LIG    1        1.475   0.656   1.516  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -1.931   0.868  -0.109  0.00  0.00    -0.010 A 
ATOM      8  C   LIG    1       -2.891  -0.175   0.041  0.00  0.00    -0.010 A 
ATOM      9  C   LIG    1       -4.263   0.120  -0.168  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1       -5.228  -0.891  -0.027  0.00  0.00    +0.008 A 
ATOM     11  C   LIG    1       -4.862  -2.191   0.318  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -3.525  -2.498   0.527  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -4.653   1.422  -0.514  0.00  0.00    +0.008 A 
ATOM     14  C   LIG    1       -3.712   2.436  -0.658  0.00  0.00    +0.001 A 
ATOM     15  C   LIG    1       -2.553  -1.504   0.391  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1       -2.363   2.161  -0.457  0.00  0.00    +0.009 A 
ENDBRANCH   4   7
BRANCH   1  17
ATOM     17  O   LIG    1        3.594   0.051   0.764  0.00  0.00    -0.478 OA
BRANCH  17  19
ATOM     18  C   LIG    1        5.840   0.646   0.251  0.00  0.00    +0.064 C 
ATOM     19  C   LIG    1        4.542   0.081  -0.311  0.00  0.00    +0.278 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.814  -1.326  -0.844  0.00  0.00    +0.346 C 
ATOM     21  O   LIG    1        5.446  -1.564  -1.863  0.00  0.00    -0.247 OA
BRANCH  20  22
ATOM     22  O   LIG    1        4.301  -2.306  -0.059  0.00  0.00    -0.478 OA
ATOM     23  H   LIG    1        3.819  -1.915   0.702  0.00  0.00    +0.295 HD
ENDBRANCH  20  22
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 5