REMARK  Name = BDB027766
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.003   0.074  -1.014  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1        1.690   0.199  -2.236  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        3.077   0.037  -2.173  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        3.760   0.149  -3.375  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        3.206   0.406  -4.590  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.874   0.576  -4.612  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.733  -0.209  -1.032  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        2.988  -0.284   0.078  0.00  0.00    +0.165 A 
ATOM      9  C   LIG    1        1.083   0.484  -3.482  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        1.655  -0.154   0.133  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        3.666  -0.536   1.331  0.00  0.00    +0.056 A 
ATOM     12  C   LIG    1        5.025  -0.711   1.499  0.00  0.00    +0.116 A 
ATOM     13  N   LIG    1        5.222  -0.921   2.832  0.00  0.00    -0.284 N 
ATOM     14  H   LIG    1        6.097  -1.085   3.319  0.00  0.00    +0.188 HD
ATOM     15  N   LIG    1        4.087  -0.899   3.551  0.00  0.00    -0.182 NA
ATOM     16  C   LIG    1        3.142  -0.662   2.635  0.00  0.00    +0.145 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -0.395   0.195  -1.007  0.00  0.00    -0.323 N 
ATOM     18  H   LIG    1       -0.763  -0.484  -1.671  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.225   0.237   0.230  0.00  0.00    +0.030 C 
ATOM     20  C   LIG    1       -0.752   1.388   1.139  0.00  0.00    +0.031 C 
ATOM     21  C   LIG    1       -1.158  -1.111   0.956  0.00  0.00    +0.031 C 
BRANCH  19  22
ATOM     22  C   LIG    1       -2.674   0.550  -0.294  0.00  0.00    +0.059 C 
BRANCH  22  24
ATOM     23  C   LIG    1       -4.382  -1.131   0.664  0.00  0.00    +0.041 C 
ATOM     24  C   LIG    1       -3.955   0.337   0.553  0.00  0.00    +0.062 C 
ATOM     25  C   LIG    1       -3.939   0.992   1.929  0.00  0.00    +0.041 C 
BRANCH  24  26
ATOM     26  O   LIG    1       -5.018   0.998  -0.168  0.00  0.00    -0.389 OA
ATOM     27  H   LIG    1       -5.114   0.568  -1.034  0.00  0.00    +0.210 HD
ENDBRANCH  24  26
ENDBRANCH  22  24
ENDBRANCH  19  22
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 6