REMARK  Name = BDB056571
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.044   0.018  -0.155  0.00  0.00    +0.125 A 
ATOM      2  N   LIG    1       -0.751   1.334  -0.066  0.00  0.00    -0.239 NA
ATOM      3  C   LIG    1        0.534   1.762  -0.141  0.00  0.00    +0.123 A 
ATOM      4  C   LIG    1        1.579   0.849  -0.295  0.00  0.00    +0.019 A 
ATOM      5  C   LIG    1        1.264  -0.503  -0.376  0.00  0.00    +0.052 A 
ATOM      6  N   LIG    1        2.446  -1.189  -0.524  0.00  0.00    -0.353 N 
ATOM      7  H   LIG    1        2.522  -2.194  -0.598  0.00  0.00    +0.166 HD
ATOM      8  C   LIG    1        3.513  -0.321  -0.529  0.00  0.00    +0.066 A 
ATOM      9  C   LIG    1        2.995   0.953  -0.399  0.00  0.00    +0.039 A 
ATOM     10  C   LIG    1       -0.053  -0.956  -0.306  0.00  0.00    +0.070 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        4.860  -0.778  -0.667  0.00  0.00    +0.085 A 
ATOM     12  N   LIG    1        5.974  -0.247  -0.059  0.00  0.00    -0.332 N 
ATOM     13  C   LIG    1        6.031   0.845   0.881  0.00  0.00    +0.150 C 
ATOM     14  C   LIG    1        7.058  -0.983  -0.453  0.00  0.00    +0.199 A 
ATOM     15  N   LIG    1        6.715  -1.954  -1.266  0.00  0.00    -0.243 NA
ATOM     16  C   LIG    1        5.358  -1.835  -1.407  0.00  0.00    +0.140 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -2.380  -0.440  -0.072  0.00  0.00    -0.297 N 
ATOM     18  H   LIG    1       -2.578  -1.103  -0.819  0.00  0.00    +0.154 HD
BRANCH  17  20
ATOM     19  C   LIG    1       -4.786  -0.156  -0.339  0.00  0.00    +0.141 A 
ATOM     20  C   LIG    1       -3.559   0.300   0.200  0.00  0.00    +0.075 A 
ATOM     21  C   LIG    1       -3.570   1.403   1.062  0.00  0.00    +0.027 A 
ATOM     22  C   LIG    1       -4.761   2.071   1.354  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1       -5.959   1.631   0.800  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -5.976   0.518  -0.043  0.00  0.00    +0.047 A 
BRANCH  19  26
ATOM     25  C   LIG    1       -5.899  -1.768  -1.700  0.00  0.00    +0.277 C 
ATOM     26  O   LIG    1       -4.688  -1.264  -1.152  0.00  0.00    -0.493 OA
ENDBRANCH  19  26
ENDBRANCH  17  20
ENDBRANCH   1  17
TORSDOF 4