REMARK  Name = BDB015845
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.306   2.162  -0.112  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1        0.483   1.095  -0.096  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -0.846   1.310  -0.028  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -1.378   2.601   0.001  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.446   3.623  -0.019  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.888   3.438  -0.066  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.652   0.332  -0.288  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        3.274   0.595  -0.228  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        2.760   1.909  -0.178  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        3.691   2.963  -0.194  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        5.065   2.720  -0.256  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        5.542   1.411  -0.303  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        7.451  -3.740   0.230  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        6.381  -2.830  -0.099  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        5.274  -3.301  -0.699  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        4.515  -2.212  -0.848  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        5.129  -1.040  -0.344  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        6.343  -1.486   0.137  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -2.800   2.890   0.029  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.392   3.893   0.769  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -4.732   3.814   0.515  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.773   4.652   1.061  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.058   2.828  -0.338  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -3.882   2.271  -0.639  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -1.708   0.191  -0.012  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1       -2.359   0.304   0.763  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.047  -1.113   0.006  0.00  0.00    +0.106 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -2.067  -2.259  -0.089  0.00  0.00    +0.008 C 
ATOM     29  C   LIG    1       -3.031  -2.317   1.102  0.00  0.00    +0.020 C 
ATOM     30  C   LIG    1       -3.941  -3.548   1.004  0.00  0.00    +0.081 C 
ATOM     31  N   LIG    1       -4.361  -3.896  -0.357  0.00  0.00    -0.316 NA
ATOM     32  H   LIG    1       -3.753  -4.633  -0.715  0.00  0.00    +0.122 HD
ATOM     33  C   LIG    1       -4.287  -2.752  -1.262  0.00  0.00    +0.081 C 
ATOM     34  C   LIG    1       -2.849  -2.251  -1.419  0.00  0.00    +0.020 C 
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 6