REMARK  Name = BDB004373
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -6.411  -2.229  -2.161  0.00  0.00    -0.266 OA
ATOM      2  C   LIG    1       -5.509  -1.687  -1.533  0.00  0.00    +0.273 A 
ATOM      3  C   LIG    1       -5.794  -0.644  -0.537  0.00  0.00    +0.053 A 
ATOM      4  C   LIG    1       -4.727  -0.072   0.137  0.00  0.00    +0.057 A 
ATOM      5  C   LIG    1       -4.928   0.917   1.090  0.00  0.00    +0.138 A 
ATOM      6  O   LIG    1       -3.909   1.515   1.785  0.00  0.00    -0.455 OA
ATOM      7  C   LIG    1       -2.622   1.110   1.519  0.00  0.00    +0.138 A 
ATOM      8  C   LIG    1       -2.288   0.126   0.586  0.00  0.00    +0.045 A 
ATOM      9  C   LIG    1       -0.949  -0.227   0.375  0.00  0.00    +0.018 A 
ATOM     10  C   LIG    1        0.068   0.404   1.106  0.00  0.00    -0.033 A 
ATOM     11  C   LIG    1       -0.277   1.397   2.035  0.00  0.00    +0.008 A 
ATOM     12  C   LIG    1       -1.613   1.746   2.243  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -6.229   1.340   1.371  0.00  0.00    +0.047 A 
ATOM     14  C   LIG    1       -7.313   0.770   0.696  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1       -3.373  -0.527  -0.170  0.00  0.00    +0.106 A 
ATOM     16  N   LIG    1       -3.121  -1.450  -1.051  0.00  0.00    -0.170 NA
ATOM     17  C   LIG    1       -7.098  -0.225  -0.261  0.00  0.00    +0.014 A 
ATOM     18  N   LIG    1       -4.181  -2.007  -1.710  0.00  0.00    -0.242 N 
ATOM     19  H   LIG    1       -3.962  -2.724  -2.393  0.00  0.00    +0.192 HD
ENDROOT
BRANCH  10  20
ATOM     20  C   LIG    1        1.519   0.043   0.877  0.00  0.00    +0.116 C 
BRANCH  20  21
ATOM     21  N   LIG    1        2.196   1.104   0.138  0.00  0.00    -0.309 NA
ATOM     22  H   LIG    1        1.641   1.347  -0.682  0.00  0.00    +0.123 HD
BRANCH  21  23
ATOM     23  C   LIG    1        3.571   0.804  -0.282  0.00  0.00    +0.054 C 
ATOM     24  C   LIG    1        3.610  -0.113  -1.522  0.00  0.00    +0.021 C 
ATOM     25  C   LIG    1        4.935  -0.871  -1.680  0.00  0.00    +0.033 C 
ATOM     26  C   LIG    1        6.122  -0.106  -1.106  0.00  0.00    +0.115 C 
ATOM     27  C   LIG    1        5.947   0.189   0.388  0.00  0.00    +0.033 C 
ATOM     28  C   LIG    1        4.481   0.278   0.835  0.00  0.00    +0.021 C 
BRANCH  26  29
ATOM     29  O   LIG    1        6.263   1.131  -1.803  0.00  0.00    -0.392 OA
ATOM     30  H   LIG    1        6.446   0.924  -2.735  0.00  0.00    +0.210 HD
ENDBRANCH  26  29
ENDBRANCH  21  23
ENDBRANCH  20  21
ENDBRANCH  10  20
TORSDOF 4