REMARK  Name = BDB011160
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.921  -2.033   0.630  0.00  0.00    +0.146 A 
ATOM      2  C   LIG    1       -2.572  -1.713   0.889  0.00  0.00    +0.114 A 
ATOM      3  N   LIG    1       -1.929  -2.320   1.909  0.00  0.00    -0.250 NA
ATOM      4  C   LIG    1       -0.617  -2.087   2.095  0.00  0.00    +0.127 A 
ATOM      5  C   LIG    1        0.097  -1.186   1.338  0.00  0.00    +0.082 A 
ATOM      6  C   LIG    1       -0.556  -0.439   0.374  0.00  0.00    +0.070 A 
ATOM      7  N   LIG    1        0.189   0.657  -0.180  0.00  0.00    -0.289 N 
ATOM      8  C   LIG    1        1.603   0.667  -0.116  0.00  0.00    +0.337 A 
ATOM      9  O   LIG    1        2.236   1.662  -0.477  0.00  0.00    -0.246 OA
ATOM     10  N   LIG    1        2.201  -0.466   0.444  0.00  0.00    -0.228 N 
ATOM     11  C   LIG    1        1.540  -1.041   1.520  0.00  0.00    +0.270 A 
ATOM     12  O   LIG    1        2.017  -1.429   2.582  0.00  0.00    -0.266 OA
ATOM     13  C   LIG    1       -1.906  -0.777   0.054  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1       -2.602  -0.305  -1.087  0.00  0.00    +0.012 A 
ATOM     15  C   LIG    1       -3.928  -0.643  -1.338  0.00  0.00    +0.004 A 
ATOM     16  C   LIG    1       -4.596  -1.491  -0.469  0.00  0.00    +0.048 A 
ENDROOT
BRANCH  10  17
ATOM     17  C   LIG    1        3.602  -0.768   0.183  0.00  0.00    +0.054 A 
ATOM     18  C   LIG    1        4.290  -0.187  -0.900  0.00  0.00    +0.026 A 
ATOM     19  C   LIG    1        5.624  -0.503  -1.191  0.00  0.00    +0.002 A 
ATOM     20  C   LIG    1        6.306  -1.432  -0.419  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        5.648  -2.053   0.632  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        4.312  -1.734   0.919  0.00  0.00    +0.026 A 
ENDBRANCH  10  17
BRANCH   7  23
ATOM     23  C   LIG    1       -0.500   1.941  -0.446  0.00  0.00    +0.092 C 
ATOM     24  C   LIG    1       -0.272   2.512  -1.856  0.00  0.00    +0.025 C 
ATOM     25  C   LIG    1       -0.362   4.018  -1.667  0.00  0.00    +0.002 C 
ATOM     26  C   LIG    1        0.330   4.249  -0.335  0.00  0.00    +0.002 C 
ATOM     27  C   LIG    1       -0.120   3.078   0.534  0.00  0.00    +0.025 C 
ENDBRANCH   7  23
BRANCH   1  29
ATOM     28  C   LIG    1       -5.865  -3.265   1.317  0.00  0.00    +0.277 C 
ATOM     29  O   LIG    1       -4.502  -2.917   1.515  0.00  0.00    -0.493 OA
ENDBRANCH   1  29
TORSDOF 3