REMARK  Name = BDB028092
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.170   0.867  -0.316  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -1.073  -0.127  -0.720  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1       -2.423   0.148  -0.607  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1       -3.567  -0.704  -0.946  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1       -4.709   0.033  -0.677  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -4.405   1.335  -0.093  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1       -3.493  -1.848  -1.352  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -2.912   1.349  -0.098  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1       -2.036   2.335   0.317  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1       -0.662   2.087   0.208  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -6.044  -0.557  -0.707  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -7.178   0.422  -1.052  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -7.014   1.508  -1.603  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -8.450  -0.002  -0.735  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -9.192   0.647  -0.960  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -8.798  -1.018   0.117  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -9.955  -1.150   0.503  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -7.697  -1.970   0.518  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -6.360  -1.253   0.618  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1        1.313   0.623  -0.391  0.00  0.00    +0.141 C 
BRANCH  20  24
ATOM     21  N   LIG    1        4.045   0.004   0.231  0.00  0.00    -0.269 N 
ATOM     22  H   LIG    1        3.678   0.012  -0.706  0.00  0.00    +0.156 HD
ATOM     23  C   LIG    1        3.124  -0.059   1.242  0.00  0.00    +0.304 C 
ATOM     24  N   LIG    1        1.829   0.151   0.873  0.00  0.00    -0.295 N 
ATOM     25  H   LIG    1        1.198   0.126   1.665  0.00  0.00    +0.151 HD
ATOM     26  O   LIG    1        3.350  -0.277   2.428  0.00  0.00    -0.252 OA
BRANCH  21  30
ATOM     27  C   LIG    1        8.264  -0.256   0.370  0.00  0.00    +0.120 A 
ATOM     28  C   LIG    1        7.536  -0.222   1.560  0.00  0.00    +0.047 A 
ATOM     29  C   LIG    1        6.139  -0.139   1.547  0.00  0.00    +0.027 A 
ATOM     30  C   LIG    1        5.448  -0.090   0.337  0.00  0.00    +0.035 A 
ATOM     31  C   LIG    1        6.181  -0.119  -0.856  0.00  0.00    +0.027 A 
ATOM     32  C   LIG    1        7.580  -0.203  -0.842  0.00  0.00    +0.047 A 
BRANCH  27  34
ATOM     33  C   LIG    1       10.404  -0.395  -0.656  0.00  0.00    +0.277 C 
ATOM     34  O   LIG    1        9.620  -0.339   0.529  0.00  0.00    -0.495 OA
ENDBRANCH  27  34
ENDBRANCH  21  30
ENDBRANCH  20  24
ENDBRANCH   1  20
TORSDOF 5