REMARK  Name = BDB062510
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.737  -0.773  -1.328  0.00  0.00    +0.218 A 
ATOM      2  N   LIG    1       -2.193  -2.020  -1.448  0.00  0.00    -0.214 NA
ATOM      3  C   LIG    1       -1.301  -2.989  -1.152  0.00  0.00    +0.085 A 
ATOM      4  C   LIG    1       -0.001  -2.718  -0.749  0.00  0.00    +0.078 A 
ATOM      5  S   LIG    1        0.869  -4.176  -0.447  0.00  0.00    -0.092 S 
ATOM      6  C   LIG    1       -0.476  -5.148  -0.853  0.00  0.00    +0.048 A 
ATOM      7  C   LIG    1        0.417  -1.385  -0.643  0.00  0.00    +0.144 A 
ATOM      8  C   LIG    1       -1.567  -4.389  -1.210  0.00  0.00    +0.036 A 
ATOM      9  N   LIG    1       -0.499  -0.439  -0.953  0.00  0.00    -0.198 NA
ENDROOT
BRANCH   1  10
ATOM     10  N   LIG    1       -2.560   0.308  -1.615  0.00  0.00    -0.309 N 
ATOM     11  H   LIG    1       -2.075   1.106  -1.215  0.00  0.00    +0.149 HD
BRANCH  10  12
ATOM     12  C   LIG    1       -3.943   0.174  -1.206  0.00  0.00    +0.139 C 
BRANCH  12  16
ATOM     13  C   LIG    1       -4.400   0.874   3.029  0.00  0.00    +0.000 A 
ATOM     14  C   LIG    1       -4.345  -0.430   2.540  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -4.201  -0.656   1.171  0.00  0.00    +0.005 A 
ATOM     16  C   LIG    1       -4.116   0.420   0.276  0.00  0.00    -0.030 A 
ATOM     17  C   LIG    1       -4.164   1.728   0.781  0.00  0.00    +0.005 A 
ATOM     18  C   LIG    1       -4.308   1.952   2.151  0.00  0.00    +0.000 A 
ENDBRANCH  12  16
ENDBRANCH  10  12
ENDBRANCH   1  10
BRANCH   7  19
ATOM     19  N   LIG    1        1.724  -1.067  -0.237  0.00  0.00    -0.282 N 
ATOM     20  H   LIG    1        2.270  -1.901  -0.064  0.00  0.00    +0.155 HD
BRANCH  19  21
ATOM     21  C   LIG    1        2.309   0.137  -0.057  0.00  0.00    +0.146 A 
ATOM     22  N   LIG    1        1.773   1.351  -0.208  0.00  0.00    -0.158 NA
ATOM     23  N   LIG    1        2.763   2.202   0.091  0.00  0.00    -0.280 N 
ATOM     24  H   LIG    1        2.574   3.197   0.041  0.00  0.00    +0.189 HD
ATOM     25  C   LIG    1        3.923   1.580   0.429  0.00  0.00    +0.041 A 
ATOM     26  C   LIG    1        3.667   0.235   0.353  0.00  0.00    +0.068 A 
BRANCH  25  27
ATOM     27  C   LIG    1        5.245   2.258   0.844  0.00  0.00    +0.037 C 
ATOM     28  C   LIG    1        5.859   3.279  -0.076  0.00  0.00    +0.010 C 
ATOM     29  C   LIG    1        6.502   1.932   0.083  0.00  0.00    +0.010 C 
ENDBRANCH  25  27
ENDBRANCH  19  21
ENDBRANCH   7  19
TORSDOF 6