REMARK  Name = BDB015900
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.477   0.257   0.443  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.675  -0.417   0.614  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.835   0.264   0.506  0.00  0.00    +0.131 A 
ATOM      4  C   LIG    1       -1.864   1.636   0.258  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.625   2.229   0.101  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.549   1.573   0.179  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        4.203  -0.585   0.443  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.992   0.122   0.349  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.741  -0.501   0.548  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        1.749  -1.875   0.851  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        2.942  -2.593   0.951  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.162  -1.950   0.748  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        8.930   0.399  -0.730  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        7.559   0.518  -0.295  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        7.093   1.715   0.100  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        5.821   1.462   0.419  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        5.466   0.104   0.234  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        6.627  -0.477  -0.235  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.080   2.421   0.184  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -3.326   3.416  -0.741  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -4.578   3.890  -0.467  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -5.284   4.937  -1.165  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -5.167   3.275   0.572  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.253   2.387   0.973  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -3.041  -0.460   0.686  0.00  0.00    -0.326 N 
ATOM     26  H   LIG    1       -3.690  -0.199  -0.056  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -3.049  -1.874   0.930  0.00  0.00    +0.075 C 
ATOM     28  C   LIG    1       -2.854  -2.728  -0.349  0.00  0.00    +0.040 C 
ATOM     29  C   LIG    1       -3.934  -3.671   0.226  0.00  0.00    +0.054 C 
ATOM     30  C   LIG    1       -4.484  -2.455   1.004  0.00  0.00    +0.040 C 
BRANCH  29  31
ATOM     31  N   LIG    1       -4.871  -4.029  -0.830  0.00  0.00    -0.327 NA
ATOM     32  H   LIG    1       -5.725  -4.468  -0.486  0.00  0.00    +0.118 HD
ATOM     33  H   LIG    1       -4.484  -4.674  -1.518  0.00  0.00    +0.118 HD
ENDBRANCH  29  31
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 6