REMARK  Name = BDB056583
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.829   2.094  -0.483  0.00  0.00    +0.125 A 
ATOM      2  N   LIG    1        1.630   3.171  -0.333  0.00  0.00    -0.239 NA
ATOM      3  C   LIG    1        2.975   3.011  -0.240  0.00  0.00    +0.123 A 
ATOM      4  C   LIG    1        3.546   1.738  -0.315  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1        2.701   0.645  -0.493  0.00  0.00    +0.052 A 
ATOM      6  N   LIG    1        3.492  -0.478  -0.554  0.00  0.00    -0.354 N 
ATOM      7  H   LIG    1        3.146  -1.417  -0.687  0.00  0.00    +0.166 HD
ATOM      8  C   LIG    1        4.811  -0.136  -0.407  0.00  0.00    +0.050 A 
ATOM      9  C   LIG    1        4.876   1.232  -0.258  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1        1.318   0.793  -0.588  0.00  0.00    +0.070 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        5.990  -1.131  -0.414  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1        7.318  -0.812  -0.269  0.00  0.00    +0.114 A 
ATOM     13  N   LIG    1        7.995  -1.995  -0.338  0.00  0.00    -0.284 N 
ATOM     14  H   LIG    1        8.996  -2.150  -0.272  0.00  0.00    +0.188 HD
ATOM     15  N   LIG    1        7.196  -3.062  -0.516  0.00  0.00    -0.182 NA
ATOM     16  C   LIG    1        5.971  -2.530  -0.563  0.00  0.00    +0.144 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -0.541   2.370  -0.590  0.00  0.00    -0.299 N 
ATOM     18  H   LIG    1       -0.643   3.381  -0.531  0.00  0.00    +0.154 HD
BRANCH  17  22
ATOM     19  C   LIG    1       -3.955   0.422   0.998  0.00  0.00    -0.026 A 
ATOM     20  C   LIG    1       -2.684   0.123   1.504  0.00  0.00    +0.007 A 
ATOM     21  C   LIG    1       -1.546   0.757   0.991  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1       -1.648   1.700  -0.036  0.00  0.00    +0.032 A 
ATOM     23  C   LIG    1       -2.923   2.002  -0.532  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -4.063   1.372  -0.025  0.00  0.00    +0.007 A 
BRANCH  19  25
ATOM     25  C   LIG    1       -5.186  -0.254   1.550  0.00  0.00    +0.178 C 
BRANCH  25  28
ATOM     26  C   LIG    1       -6.273  -2.845  -0.723  0.00  0.00    +0.041 A 
ATOM     27  C   LIG    1       -5.361  -2.377   0.193  0.00  0.00    +0.108 A 
ATOM     28  N   LIG    1       -5.803  -1.139   0.571  0.00  0.00    -0.267 N 
ATOM     29  N   LIG    1       -6.963  -0.787  -0.025  0.00  0.00    -0.179 NA
ATOM     30  C   LIG    1       -7.237  -1.825  -0.820  0.00  0.00    +0.134 A 
ENDBRANCH  25  28
ENDBRANCH  19  25
ENDBRANCH  17  22
ENDBRANCH   1  17
TORSDOF 5