REMARK  Name = BDB060604
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.261  -2.071  -0.583  0.00  0.00    +0.253 C 
ATOM      2  C   LIG    1        0.535  -2.435   0.712  0.00  0.00    +0.195 C 
ATOM      3  C   LIG    1       -0.586  -1.409   0.755  0.00  0.00    +0.177 C 
ATOM      4  C   LIG    1       -0.931  -1.229  -0.729  0.00  0.00    +0.166 C 
ATOM      5  O   LIG    1        0.228  -1.640  -1.500  0.00  0.00    -0.347 OA
ENDROOT
BRANCH   1  10
ATOM      6  C   LIG    1        4.503   1.277   0.833  0.00  0.00    +0.147 A 
ATOM      7  C   LIG    1        3.780   0.464  -0.056  0.00  0.00    +0.147 A 
ATOM      8  N   LIG    1        3.819   0.331  -1.427  0.00  0.00    -0.231 NA
ATOM      9  C   LIG    1        2.908  -0.578  -1.699  0.00  0.00    +0.203 A 
ATOM     10  N   LIG    1        2.278  -1.040  -0.566  0.00  0.00    -0.286 N 
ATOM     11  C   LIG    1        2.826  -0.377   0.497  0.00  0.00    +0.167 A 
ATOM     12  N   LIG    1        2.521  -0.495   1.798  0.00  0.00    -0.216 NA
ATOM     13  C   LIG    1        3.261   0.343   2.553  0.00  0.00    +0.225 A 
ATOM     14  N   LIG    1        4.213   1.209   2.151  0.00  0.00    -0.219 NA
BRANCH   6  15
ATOM     15  N   LIG    1        5.490   2.163   0.422  0.00  0.00    -0.341 N 
ATOM     16  H   LIG    1        5.636   2.907   1.091  0.00  0.00    +0.144 HD
ATOM     17  H   LIG    1        5.420   2.416  -0.557  0.00  0.00    +0.144 HD
ENDBRANCH   6  15
ENDBRANCH   1  10
BRANCH   2  18
ATOM     18  O   LIG    1       -0.073  -3.748   0.605  0.00  0.00    -0.385 OA
ATOM     19  H   LIG    1        0.637  -4.405   0.724  0.00  0.00    +0.210 HD
ENDBRANCH   2  18
BRANCH   3  20
ATOM     20  O   LIG    1       -1.681  -1.910   1.522  0.00  0.00    -0.386 OA
ATOM     21  H   LIG    1       -1.700  -2.873   1.345  0.00  0.00    +0.210 HD
ENDBRANCH   3  20
BRANCH   4  22
ATOM     22  C   LIG    1       -1.260   0.227  -1.122  0.00  0.00    +0.118 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -2.358   0.849  -0.383  0.00  0.00    -0.300 NA
ATOM     24  C   LIG    1       -3.654   0.203  -0.599  0.00  0.00    +0.084 C 
ATOM     25  C   LIG    1       -4.650   1.234  -0.087  0.00  0.00    +0.017 C 
ATOM     26  C   LIG    1       -3.917   2.569  -0.150  0.00  0.00    +0.017 C 
ATOM     27  C   LIG    1       -2.564   2.247  -0.764  0.00  0.00    +0.084 C 
ENDBRANCH  22  23
ENDBRANCH   4  22
TORSDOF 6