REMARK  Name = BDB001736
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.933  -0.489  -0.924  0.00  0.00    +0.281 C 
ATOM      2  N   LIG    1        0.274   0.024  -0.412  0.00  0.00    -0.163 N 
ATOM      3  C   LIG    1        0.528   0.786   0.725  0.00  0.00    +0.219 A 
ATOM      4  N   LIG    1        1.819   0.948   0.862  0.00  0.00    -0.193 NA
ATOM      5  C   LIG    1        2.356   0.342  -0.248  0.00  0.00    +0.184 A 
ATOM      6  N   LIG    1        1.447  -0.200  -1.067  0.00  0.00    -0.141 NA
ATOM      7  O   LIG    1       -0.950  -0.917  -2.080  0.00  0.00    -0.265 OA
ENDROOT
BRANCH   5   8
ATOM      8  C   LIG    1        3.795   0.316  -0.500  0.00  0.00    +0.021 A 
ATOM      9  C   LIG    1        4.685   0.902   0.410  0.00  0.00    +0.012 A 
ATOM     10  C   LIG    1        6.064   0.880   0.177  0.00  0.00    +0.004 A 
ATOM     11  C   LIG    1        6.579   0.262  -0.968  0.00  0.00    -0.050 A 
ATOM     12  C   LIG    1        8.055   0.267  -1.236  0.00  0.00    +0.044 C 
ATOM     13  C   LIG    1        5.694  -0.312  -1.886  0.00  0.00    +0.004 A 
ATOM     14  C   LIG    1        4.315  -0.290  -1.652  0.00  0.00    +0.012 A 
ENDBRANCH   5   8
BRANCH   1  18
ATOM     15  C   LIG    1       -4.659  -0.651   1.171  0.00  0.00    +0.162 A 
ATOM     16  C   LIG    1       -4.601  -0.145  -0.144  0.00  0.00    +0.162 A 
ATOM     17  C   LIG    1       -3.375  -0.098  -0.815  0.00  0.00    +0.062 A 
ATOM     18  C   LIG    1       -2.211  -0.545  -0.180  0.00  0.00    +0.045 A 
ATOM     19  C   LIG    1       -2.271  -1.081   1.108  0.00  0.00    +0.017 A 
ATOM     20  C   LIG    1       -3.493  -1.124   1.784  0.00  0.00    +0.050 A 
BRANCH  15  22
ATOM     21  C   LIG    1       -6.013  -1.209   3.062  0.00  0.00    +0.277 C 
ATOM     22  O   LIG    1       -5.897  -0.646   1.763  0.00  0.00    -0.491 OA
ENDBRANCH  15  22
BRANCH  16  23
ATOM     23  O   LIG    1       -5.788   0.293  -0.677  0.00  0.00    -0.491 OA
ATOM     24  C   LIG    1       -5.820   0.567  -2.072  0.00  0.00    +0.277 C 
ENDBRANCH  16  23
ENDBRANCH   1  18
BRANCH   3  25
ATOM     25  N   LIG    1       -0.397   1.315   1.557  0.00  0.00    -0.327 N 
ATOM     26  H   LIG    1       -1.278   1.656   1.181  0.00  0.00    +0.145 HD
ATOM     27  H   LIG    1       -0.009   1.986   2.220  0.00  0.00    +0.145 HD
ENDBRANCH   3  25
TORSDOF 5