REMARK  Name = BDB015872
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.190   1.614  -0.167  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -0.526   0.508   0.116  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.873   0.576   0.044  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -2.522   1.765  -0.297  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -1.692   2.836  -0.575  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1       -0.347   2.792  -0.523  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.696   0.194   0.355  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.297   0.313   0.290  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.662   1.513  -0.095  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        2.491   2.605  -0.411  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        3.883   2.505  -0.349  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        4.481   1.305   0.033  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        6.844  -3.620   0.827  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        5.704  -2.745   0.949  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        4.661  -3.121   1.710  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        3.809  -2.098   1.597  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.298  -1.065   0.761  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.535  -1.527   0.357  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -3.959   1.929  -0.387  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -4.869   1.531   0.571  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -6.098   1.900   0.110  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -7.368   1.690   0.759  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -6.056   2.529  -1.079  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -4.754   2.547  -1.378  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -2.626  -0.584   0.330  0.00  0.00    -0.327 N 
ATOM     26  H   LIG    1       -3.279  -0.715  -0.445  0.00  0.00    +0.148 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -1.879  -1.823   0.573  0.00  0.00    +0.118 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -1.721  -2.672  -0.711  0.00  0.00    +0.096 C 
BRANCH  28  29
ATOM     29  N   LIG    1       -1.381  -1.901  -1.910  0.00  0.00    -0.329 NA
ATOM     30  H   LIG    1       -0.673  -1.206  -1.657  0.00  0.00    +0.118 HD
ATOM     31  H   LIG    1       -0.953  -2.514  -2.601  0.00  0.00    +0.118 HD
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 7