REMARK  Name = BDB014827
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.584   0.041   0.351  0.00  0.00    -0.018 A 
ATOM      2  C   LIG    1        1.866  -0.793  -0.515  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1        0.469  -0.711  -0.614  0.00  0.00    +0.024 A 
ATOM      4  C   LIG    1       -0.260   0.205   0.147  0.00  0.00    +0.032 A 
ATOM      5  C   LIG    1        0.461   1.041   1.015  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1        1.856   0.962   1.115  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        6.866  -0.215   0.658  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1        6.077  -1.359   0.811  0.00  0.00    +0.013 A 
ATOM      9  C   LIG    1        4.684  -1.273   0.715  0.00  0.00    +0.009 A 
ATOM     10  C   LIG    1        4.050  -0.047   0.454  0.00  0.00    -0.018 A 
ATOM     11  C   LIG    1        4.857   1.091   0.286  0.00  0.00    +0.009 A 
ATOM     12  C   LIG    1        6.252   1.011   0.381  0.00  0.00    +0.013 A 
BRANCH   7  16
ATOM     13  C   LIG    1       10.450   0.702   1.444  0.00  0.00    +0.128 C 
ATOM     14  N   LIG    1        9.033   0.770   1.187  0.00  0.00    -0.314 N 
ATOM     15  H   LIG    1        8.513   1.521   1.620  0.00  0.00    +0.149 HD
ATOM     16  C   LIG    1        8.345  -0.351   0.768  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1        8.885  -1.425   0.527  0.00  0.00    -0.270 OA
ENDBRANCH   7  16
ENDBRANCH   1  10
BRANCH   4  18
ATOM     18  N   LIG    1       -1.666   0.335   0.093  0.00  0.00    -0.298 N 
ATOM     19  H   LIG    1       -1.987   1.065   0.717  0.00  0.00    +0.154 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.609  -0.348  -0.602  0.00  0.00    +0.150 A 
ATOM     21  C   LIG    1       -3.989  -0.016  -0.519  0.00  0.00    +0.032 A 
ATOM     22  C   LIG    1       -4.695   1.049   0.239  0.00  0.00    +0.148 C 
ATOM     23  N   LIG    1       -6.159   0.894   0.128  0.00  0.00    -0.297 N 
ATOM     24  C   LIG    1       -6.696   0.396  -1.159  0.00  0.00    +0.114 C 
ATOM     25  C   LIG    1       -6.087  -0.957  -1.586  0.00  0.00    +0.074 C 
ATOM     26  C   LIG    1       -6.911   1.627   1.038  0.00  0.00    +0.213 C 
ATOM     27  O   LIG    1       -6.395   2.294   1.936  0.00  0.00    -0.276 OA
ATOM     28  C   LIG    1       -8.411   1.574   0.901  0.00  0.00    +0.109 C 
ATOM     29  C   LIG    1       -4.627  -0.913  -1.350  0.00  0.00    +0.047 A 
ATOM     30  N   LIG    1       -3.659  -1.720  -1.854  0.00  0.00    -0.269 N 
ATOM     31  C   LIG    1       -3.807  -2.836  -2.756  0.00  0.00    +0.172 C 
ATOM     32  N   LIG    1       -2.429  -1.381  -1.434  0.00  0.00    -0.156 NA
ENDBRANCH  18  20
ENDBRANCH   4  18
TORSDOF 4