REMARK  Name = BDB001134
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -6.345  -3.372  -1.212  0.00  0.00    -0.267 OA
ATOM      2  C   LIG    1       -5.660  -2.372  -1.024  0.00  0.00    +0.257 A 
ATOM      3  C   LIG    1       -6.261  -1.091  -0.571  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -5.441   0.037  -0.363  0.00  0.00    -0.004 A 
ATOM      5  C   LIG    1       -6.078   1.217   0.065  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -7.461   1.268   0.276  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -8.246   0.140   0.065  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -3.984  -0.071  -0.601  0.00  0.00    +0.006 A 
ATOM      9  C   LIG    1       -3.456  -1.302  -1.031  0.00  0.00    +0.050 A 
ATOM     10  C   LIG    1       -2.090  -1.471  -1.273  0.00  0.00    +0.026 A 
ATOM     11  C   LIG    1       -1.215  -0.405  -1.088  0.00  0.00    +0.005 A 
ATOM     12  C   LIG    1       -1.700   0.835  -0.662  0.00  0.00    -0.047 A 
ATOM     13  C   LIG    1       -3.077   0.990  -0.422  0.00  0.00    +0.014 A 
ATOM     14  C   LIG    1       -7.647  -1.042  -0.359  0.00  0.00    +0.014 A 
ATOM     15  N   LIG    1       -4.304  -2.397  -1.226  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1       -3.927  -3.283  -1.536  0.00  0.00    +0.169 HD
ENDROOT
BRANCH  12  17
ATOM     17  C   LIG    1       -0.748   1.988  -0.444  0.00  0.00    +0.036 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -0.413   2.239   1.031  0.00  0.00    +0.020 C 
BRANCH  18  19
ATOM     19  C   LIG    1        0.339   1.091   1.724  0.00  0.00    +0.085 C 
BRANCH  19  20
ATOM     20  N   LIG    1        1.569   0.673   1.035  0.00  0.00    -0.298 NA
ATOM     21  C   LIG    1        2.644   1.671   1.131  0.00  0.00    +0.089 C 
ATOM     22  C   LIG    1        3.846   1.257   0.263  0.00  0.00    +0.051 C 
ATOM     23  C   LIG    1        4.246  -0.183   0.477  0.00  0.00    -0.042 C 
ATOM     24  C   LIG    1        3.393  -1.028   1.084  0.00  0.00    -0.008 C 
ATOM     25  C   LIG    1        2.030  -0.620   1.570  0.00  0.00    +0.112 C 
BRANCH  23  26
ATOM     26  C   LIG    1        5.574  -0.623  -0.000  0.00  0.00    -0.022 A 
ATOM     27  C   LIG    1        6.395  -1.436   0.796  0.00  0.00    +0.008 A 
ATOM     28  C   LIG    1        7.657  -1.837   0.350  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        8.119  -1.426  -0.898  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        7.319  -0.614  -1.699  0.00  0.00    +0.001 A 
ATOM     31  C   LIG    1        6.057  -0.213  -1.251  0.00  0.00    +0.008 A 
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  12  17
TORSDOF 5