REMARK  Name = BDB028108
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.473  -1.954   0.580  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1        1.563  -1.522  -0.188  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1        2.518  -0.740   0.437  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1        3.747  -0.166  -0.121  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1        4.360   0.534   0.901  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        3.606   0.478   2.144  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1        4.113  -0.292  -1.272  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.433  -0.365   1.776  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1        1.362  -0.776   2.546  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1        0.381  -1.571   1.940  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        5.640   1.226   0.813  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        5.603   2.295  -0.283  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        4.877   3.287  -0.213  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        6.384   2.075  -1.391  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        6.324   2.773  -2.117  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        7.121   0.962  -1.706  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1        7.726   0.892  -2.774  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        7.138  -0.166  -0.702  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        6.859   0.314   0.711  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1       -0.620  -2.787  -0.045  0.00  0.00    +0.141 C 
BRANCH  20  24
ATOM     21  N   LIG    1       -3.715  -0.897  -0.184  0.00  0.00    -0.266 N 
ATOM     22  H   LIG    1       -3.561  -0.628  -1.147  0.00  0.00    +0.156 HD
ATOM     23  C   LIG    1       -2.823  -1.780   0.372  0.00  0.00    +0.304 C 
ATOM     24  N   LIG    1       -1.734  -1.961  -0.454  0.00  0.00    -0.295 N 
ATOM     25  H   LIG    1       -1.518  -1.198  -1.076  0.00  0.00    +0.151 HD
ATOM     26  O   LIG    1       -2.942  -2.363   1.442  0.00  0.00    -0.252 OA
BRANCH  21  28
ATOM     27  C   LIG    1       -5.717   0.406  -0.482  0.00  0.00    +0.142 A 
ATOM     28  C   LIG    1       -4.926  -0.411   0.355  0.00  0.00    +0.077 A 
ATOM     29  C   LIG    1       -5.359  -0.690   1.653  0.00  0.00    +0.027 A 
ATOM     30  C   LIG    1       -6.568  -0.171   2.119  0.00  0.00    +0.002 A 
ATOM     31  C   LIG    1       -7.350   0.631   1.292  0.00  0.00    +0.004 A 
ATOM     32  C   LIG    1       -6.927   0.921  -0.007  0.00  0.00    +0.047 A 
BRANCH  27  33
ATOM     33  O   LIG    1       -5.205   0.630  -1.741  0.00  0.00    -0.490 OA
BRANCH  33  35
ATOM     34  C   LIG    1       -5.225   1.545  -3.939  0.00  0.00    +0.048 C 
ATOM     35  C   LIG    1       -5.979   1.438  -2.626  0.00  0.00    +0.226 C 
ENDBRANCH  33  35
ENDBRANCH  27  33
ENDBRANCH  21  28
ENDBRANCH  20  24
ENDBRANCH   1  20
TORSDOF 6