REMARK  Name = BDB060015
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.404   0.862  -0.038  0.00  0.00    +0.171 C 
ATOM      2  C   LIG    1        0.662   1.443  -1.452  0.00  0.00    +0.254 C 
ATOM      3  O   LIG    1        0.738   0.833  -2.509  0.00  0.00    -0.272 OA
ATOM      4  N   LIG    1        0.764   2.796  -1.304  0.00  0.00    -0.245 N 
ATOM      5  C   LIG    1        1.043   3.698  -2.396  0.00  0.00    +0.141 C 
ATOM      6  C   LIG    1        0.505   3.111  -0.025  0.00  0.00    +0.183 C 
ATOM      7  N   LIG    1        0.261   2.128   0.779  0.00  0.00    -0.234 NA
ENDROOT
BRANCH   1   8
ATOM      8  C   LIG    1       -0.975   0.079   0.045  0.00  0.00    +0.009 C 
ATOM      9  C   LIG    1       -0.961  -1.257  -0.758  0.00  0.00    +0.013 C 
ATOM     10  C   LIG    1       -2.312  -1.989  -0.665  0.00  0.00    -0.010 C 
ATOM     11  C   LIG    1       -3.421  -1.090  -1.227  0.00  0.00    +0.007 C 
ATOM     12  C   LIG    1       -3.497   0.212  -0.418  0.00  0.00    -0.010 C 
ATOM     13  C   LIG    1       -3.791  -0.113   1.053  0.00  0.00    +0.007 C 
ATOM     14  C   LIG    1       -2.682  -1.011   1.620  0.00  0.00    -0.010 C 
ATOM     15  C   LIG    1       -2.613  -2.311   0.806  0.00  0.00    +0.007 C 
ATOM     16  C   LIG    1       -2.149   0.947  -0.515  0.00  0.00    +0.013 C 
ATOM     17  C   LIG    1       -1.332  -0.279   1.524  0.00  0.00    +0.013 C 
ENDBRANCH   1   8
BRANCH   1  20
ATOM     18  C   LIG    1        3.426  -1.560   0.097  0.00  0.00    +0.120 A 
ATOM     19  C   LIG    1        2.326  -0.827  -0.368  0.00  0.00    +0.052 A 
ATOM     20  C   LIG    1        1.621   0.060   0.465  0.00  0.00    -0.007 A 
ATOM     21  C   LIG    1        2.060   0.186   1.795  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1        3.156  -0.540   2.266  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        3.839  -1.412   1.418  0.00  0.00    +0.045 A 
BRANCH  18  25
ATOM     24  C   LIG    1        5.119  -3.149  -0.416  0.00  0.00    +0.277 C 
ATOM     25  O   LIG    1        3.999  -2.381  -0.836  0.00  0.00    -0.495 OA
ENDBRANCH  18  25
ENDBRANCH   1  20
BRANCH   6  26
ATOM     26  N   LIG    1        0.472   4.394   0.405  0.00  0.00    -0.331 N 
ATOM     27  H   LIG    1        0.137   5.084  -0.252  0.00  0.00    +0.145 HD
ATOM     28  H   LIG    1        0.045   4.478   1.323  0.00  0.00    +0.145 HD
ENDBRANCH   6  26
TORSDOF 4