REMARK  Name = BDB008924
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.287   0.909   0.693  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.785   0.927  -0.211  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -1.935   1.685   0.064  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -1.981   2.445   1.242  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.921   2.415   2.150  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.207   1.641   1.882  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        2.155  -0.356   1.374  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        1.512   0.104   0.439  0.00  0.00    +0.244 C 
ATOM      9  N   LIG    1        1.878  -0.046  -0.883  0.00  0.00    -0.310 N 
ATOM     10  H   LIG    1        1.446   0.540  -1.585  0.00  0.00    +0.149 HD
BRANCH   9  11
ATOM     11  C   LIG    1        3.100  -0.743  -1.245  0.00  0.00    +0.120 C 
BRANCH  11  12
ATOM     12  C   LIG    1        4.360   0.108  -0.990  0.00  0.00    +0.103 C 
BRANCH  12  13
ATOM     13  N   LIG    1        5.595  -0.538  -1.466  0.00  0.00    -0.297 NA
ATOM     14  C   LIG    1        6.681   0.460  -1.591  0.00  0.00    +0.112 C 
ATOM     15  C   LIG    1        8.067  -0.201  -1.580  0.00  0.00    +0.175 C 
ATOM     16  O   LIG    1        8.358  -0.856  -0.338  0.00  0.00    -0.377 OA
ATOM     17  C   LIG    1        7.182  -1.300   0.352  0.00  0.00    +0.175 C 
ATOM     18  C   LIG    1        6.025  -1.659  -0.597  0.00  0.00    +0.112 C 
ENDBRANCH  12  13
ENDBRANCH  11  12
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  19
ATOM     19  C   LIG    1       -3.087   1.703  -0.915  0.00  0.00    +0.092 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -4.448   1.457  -0.269  0.00  0.00    +0.069 A 
ATOM     21  C   LIG    1       -4.805   0.085   0.212  0.00  0.00    -0.016 A 
ATOM     22  C   LIG    1       -3.862  -1.072   0.031  0.00  0.00    +0.037 C 
ATOM     23  C   LIG    1       -4.525  -2.434   0.260  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -5.409  -2.412   1.501  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -6.504  -1.352   1.374  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1       -6.005  -0.053   0.804  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1       -6.914   1.115   0.927  0.00  0.00    +0.268 A 
ATOM     28  O   LIG    1       -8.021   1.021   1.446  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -6.443   2.296   0.421  0.00  0.00    -0.243 N 
ATOM     30  H   LIG    1       -7.050   3.105   0.496  0.00  0.00    +0.192 HD
ATOM     31  N   LIG    1       -5.232   2.489  -0.165  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 6