REMARK  Name = BDB011170
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.163  -3.699   0.224  0.00  0.00    +0.146 A 
ATOM      2  C   LIG    1       -1.902  -3.085   0.378  0.00  0.00    +0.114 A 
ATOM      3  N   LIG    1       -0.897  -3.774   0.954  0.00  0.00    -0.250 NA
ATOM      4  C   LIG    1        0.331  -3.226   1.007  0.00  0.00    +0.127 A 
ATOM      5  C   LIG    1        0.605  -1.944   0.582  0.00  0.00    +0.082 A 
ATOM      6  C   LIG    1       -0.429  -1.151   0.122  0.00  0.00    +0.070 A 
ATOM      7  N   LIG    1       -0.131   0.237  -0.079  0.00  0.00    -0.289 N 
ATOM      8  C   LIG    1        1.188   0.683  -0.289  0.00  0.00    +0.337 A 
ATOM      9  O   LIG    1        1.373   1.845  -0.657  0.00  0.00    -0.246 OA
ATOM     10  N   LIG    1        2.217  -0.240  -0.054  0.00  0.00    -0.228 N 
ATOM     11  C   LIG    1        1.974  -1.441   0.615  0.00  0.00    +0.270 A 
ATOM     12  O   LIG    1        2.798  -2.104   1.244  0.00  0.00    -0.266 OA
ATOM     13  C   LIG    1       -1.703  -1.764  -0.103  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1       -2.757  -1.181  -0.851  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -3.991  -1.806  -1.011  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1       -4.203  -3.056  -0.453  0.00  0.00    +0.048 A 
ENDROOT
BRANCH   7  17
ATOM     17  C   LIG    1       -1.152   1.267   0.260  0.00  0.00    +0.092 C 
ATOM     18  C   LIG    1       -1.515   2.201  -0.916  0.00  0.00    +0.025 C 
ATOM     19  C   LIG    1       -1.243   3.679  -0.637  0.00  0.00    +0.005 C 
ATOM     20  C   LIG    1       -1.872   4.178   0.674  0.00  0.00    -0.014 C 
ATOM     21  C   LIG    1       -3.315   4.642   0.461  0.00  0.00    +0.007 C 
ATOM     22  C   LIG    1       -1.805   3.141   1.810  0.00  0.00    +0.005 C 
ATOM     23  C   LIG    1       -0.778   2.046   1.542  0.00  0.00    +0.025 C 
ENDBRANCH   7  17
BRANCH  10  24
ATOM     24  C   LIG    1        3.603   0.121  -0.293  0.00  0.00    +0.055 A 
ATOM     25  C   LIG    1        4.543  -0.876  -0.625  0.00  0.00    +0.029 A 
ATOM     26  C   LIG    1        5.890  -0.576  -0.890  0.00  0.00    -0.048 A 
ATOM     27  C   LIG    1        6.861  -1.674  -1.206  0.00  0.00    +0.044 C 
ATOM     28  C   LIG    1        6.320   0.748  -0.801  0.00  0.00    +0.003 A 
ATOM     29  C   LIG    1        5.415   1.752  -0.474  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1        4.072   1.441  -0.226  0.00  0.00    +0.026 A 
ENDBRANCH  10  24
BRANCH   1  32
ATOM     31  C   LIG    1       -4.524  -5.633   0.644  0.00  0.00    +0.277 C 
ATOM     32  O   LIG    1       -3.278  -4.963   0.765  0.00  0.00    -0.493 OA
ENDBRANCH   1  32
TORSDOF 3