REMARK  Name = BDB061151
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.101   0.993  -0.685  0.00  0.00    -0.021 A 
ATOM      2  C   LIG    1       -0.853   2.146  -0.441  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1       -2.034   2.102   0.320  0.00  0.00    -0.008 A 
ATOM      4  C   LIG    1       -2.761   3.387   0.589  0.00  0.00    +0.047 C 
ATOM      5  C   LIG    1       -2.501   0.859   0.779  0.00  0.00    +0.128 A 
ATOM      6  C   LIG    1       -1.728  -0.300   0.600  0.00  0.00    -0.008 A 
ATOM      7  C   LIG    1       -2.130  -1.633   1.160  0.00  0.00    +0.047 C 
ATOM      8  C   LIG    1       -0.550  -0.224  -0.163  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  16
ATOM      9  C   LIG    1        5.918  -1.821   0.196  0.00  0.00    +0.124 A 
ATOM     10  C   LIG    1        4.579  -1.543   0.506  0.00  0.00    +0.092 A 
ATOM     11  C   LIG    1        3.874  -0.716  -0.341  0.00  0.00    +0.143 A 
ATOM     12  O   LIG    1        2.560  -0.342  -0.188  0.00  0.00    -0.451 OA
ATOM     13  C   LIG    1        2.274   0.488  -1.267  0.00  0.00    +0.176 C 
ATOM     14  C   LIG    1        3.467   0.646  -2.141  0.00  0.00    +0.231 C 
ATOM     15  O   LIG    1        3.593   1.288  -3.160  0.00  0.00    -0.283 OA
ATOM     16  C   LIG    1        1.106   1.096  -1.513  0.00  0.00    +0.058 C 
ATOM     17  C   LIG    1        4.472  -0.170  -1.471  0.00  0.00    +0.068 A 
ATOM     18  C   LIG    1        5.786  -0.422  -1.807  0.00  0.00    +0.019 A 
ATOM     19  C   LIG    1        6.514  -1.261  -0.955  0.00  0.00    +0.046 A 
BRANCH   9  21
ATOM     20  C   LIG    1        7.904  -2.965   0.841  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1        6.540  -2.651   1.090  0.00  0.00    -0.495 OA
ENDBRANCH   9  21
ENDBRANCH   1  16
BRANCH   5  22
ATOM     22  O   LIG    1       -3.671   0.785   1.489  0.00  0.00    -0.475 OA
BRANCH  22  23
ATOM     23  C   LIG    1       -4.866   0.631   0.702  0.00  0.00    +0.200 C 
ATOM     24  C   LIG    1       -5.519  -0.701   1.121  0.00  0.00    +0.067 C 
ATOM     25  C   LIG    1       -5.832   1.742   1.160  0.00  0.00    +0.067 C 
BRANCH  23  26
ATOM     26  C   LIG    1       -4.784   0.689  -0.848  0.00  0.00    +0.348 C 
ATOM     27  O   LIG    1       -5.027   1.656  -1.556  0.00  0.00    -0.247 OA
BRANCH  26  28
ATOM     28  O   LIG    1       -4.382  -0.466  -1.422  0.00  0.00    -0.478 OA
ATOM     29  H   LIG    1       -4.305  -0.240  -2.373  0.00  0.00    +0.295 HD
ENDBRANCH  26  28
ENDBRANCH  23  26
ENDBRANCH  22  23
ENDBRANCH   5  22
TORSDOF 6