REMARK  Name = BDB061206
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.462   0.164  -0.050  0.00  0.00    +0.031 A 
ATOM      2  C   LIG    1        1.782  -0.287  -1.188  0.00  0.00    +0.063 A 
ATOM      3  C   LIG    1        0.390  -0.169  -1.248  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -0.299  -0.678  -2.434  0.00  0.00    +0.144 A 
ATOM      5  N   LIG    1        0.300  -1.191  -3.462  0.00  0.00    -0.179 NA
ATOM      6  N   LIG    1        1.654  -1.265  -3.415  0.00  0.00    -0.243 N 
ATOM      7  H   LIG    1        2.112  -1.683  -4.220  0.00  0.00    +0.192 HD
ATOM      8  C   LIG    1       -0.321   0.403  -0.190  0.00  0.00    +0.128 A 
ATOM      9  N   LIG    1        0.324   0.818   0.917  0.00  0.00    -0.239 NA
ATOM     10  C   LIG    1        2.457  -0.889  -2.363  0.00  0.00    +0.273 A 
ATOM     11  O   LIG    1        3.667  -1.068  -2.416  0.00  0.00    -0.266 OA
ATOM     12  C   LIG    1        1.673   0.703   0.962  0.00  0.00    +0.123 A 
ENDROOT
BRANCH   1  18
ATOM     13  C   LIG    1        7.345   1.337   0.711  0.00  0.00    +0.067 C 
ATOM     14  C   LIG    1        6.048   0.644   0.530  0.00  0.00    +0.061 A 
ATOM     15  N   LIG    1        5.967  -0.681   0.677  0.00  0.00    -0.176 NA
ATOM     16  N   LIG    1        4.678  -0.969   0.403  0.00  0.00    -0.266 N 
ATOM     17  C   LIG    1        4.271  -2.355   0.440  0.00  0.00    +0.173 C 
ATOM     18  C   LIG    1        3.907   0.145   0.159  0.00  0.00    +0.071 A 
ATOM     19  C   LIG    1        4.792   1.207   0.224  0.00  0.00    +0.052 A 
ENDBRANCH   1  18
BRANCH   8  20
ATOM     20  N   LIG    1       -1.718   0.527  -0.240  0.00  0.00    -0.324 N 
ATOM     21  H   LIG    1       -1.988   1.058  -1.066  0.00  0.00    +0.148 HD
BRANCH  20  22
ATOM     22  C   LIG    1       -2.328   1.121   0.950  0.00  0.00    +0.141 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.822   1.127   0.779  0.00  0.00    +0.012 A 
ATOM     24  C   LIG    1       -4.577  -0.043   0.787  0.00  0.00    +0.005 A 
ATOM     25  C   LIG    1       -4.142  -1.457   0.892  0.00  0.00    +0.080 C 
ATOM     26  C   LIG    1       -5.502  -2.115   1.129  0.00  0.00    +0.234 C 
ATOM     27  O   LIG    1       -6.542  -1.248   0.619  0.00  0.00    -0.491 OA
ATOM     28  C   LIG    1       -5.953  -0.011   0.604  0.00  0.00    +0.124 A 
ATOM     29  C   LIG    1       -6.642   1.168   0.403  0.00  0.00    +0.049 A 
ATOM     30  C   LIG    1       -5.910   2.355   0.399  0.00  0.00    +0.042 A 
ATOM     31  C   LIG    1       -4.520   2.326   0.585  0.00  0.00    +0.129 A 
ATOM     32  F   LIG    1       -3.851   3.488   0.558  0.00  0.00    -0.205 F 
ENDBRANCH  22  23
ENDBRANCH  20  22
ENDBRANCH   8  20
TORSDOF 4