REMARK  Name = BDB027892
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.579  -1.127   0.526  0.00  0.00    -0.333 N 
ATOM      2  H   LIG    1       -0.672  -1.850   1.248  0.00  0.00    +0.147 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.664  -0.140   0.638  0.00  0.00    +0.158 C 
ATOM      4  C   LIG    1       -2.740  -0.681   1.600  0.00  0.00    +0.239 C 
ATOM      5  O   LIG    1       -2.495  -1.520   2.467  0.00  0.00    -0.273 OA
ATOM      6  N   LIG    1       -4.005  -0.164   1.457  0.00  0.00    -0.255 N 
ATOM      7  H   LIG    1       -4.704  -0.532   2.088  0.00  0.00    +0.158 HD
ATOM      8  C   LIG    1       -4.487   0.557   0.395  0.00  0.00    +0.219 C 
ATOM      9  O   LIG    1       -5.683   0.811   0.293  0.00  0.00    -0.275 OA
ATOM     10  C   LIG    1       -3.466   1.056  -0.600  0.00  0.00    +0.098 C 
ATOM     11  C   LIG    1       -2.305   0.083  -0.730  0.00  0.00    +0.041 C 
ENDBRANCH   1   3
BRANCH   1  16
ATOM     12  C   LIG    1        4.963   0.158  -0.265  0.00  0.00    +0.045 C 
ATOM     13  C   LIG    1        3.502  -0.135  -0.057  0.00  0.00    -0.033 A 
ATOM     14  C   LIG    1        2.506   0.806  -0.363  0.00  0.00    +0.056 A 
ATOM     15  C   LIG    1        1.149   0.496  -0.160  0.00  0.00    +0.042 A 
ATOM     16  C   LIG    1        0.752  -0.734   0.372  0.00  0.00    +0.029 A 
ATOM     17  C   LIG    1        1.755  -1.677   0.630  0.00  0.00    +0.023 A 
ATOM     18  C   LIG    1        3.109  -1.384   0.434  0.00  0.00    +0.006 A 
BRANCH  14  19
ATOM     19  C   LIG    1        2.837   2.098  -0.896  0.00  0.00    +0.099 C 
ATOM     20  N   LIG    1        3.093   3.146  -1.325  0.00  0.00    -0.191 NA
ENDBRANCH  14  19
ENDBRANCH   1  16
TORSDOF 3