REMARK  Name = BDB056261
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.064  -0.315   1.211  0.00  0.00    +0.055 A 
ATOM      2  C   LIG    1       -0.191   0.276   1.193  0.00  0.00    +0.124 A 
ATOM      3  N   LIG    1       -1.245  -0.218   0.497  0.00  0.00    -0.250 NA
ATOM      4  C   LIG    1       -1.041  -1.382  -0.178  0.00  0.00    +0.126 A 
ATOM      5  C   LIG    1        0.183  -2.049  -0.198  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1        1.250  -1.512   0.521  0.00  0.00    +0.017 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1        1.884   0.518   3.199  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.132   0.301   2.016  0.00  0.00    +0.248 C 
ATOM      9  N   LIG    1        3.353   0.604   1.404  0.00  0.00    -0.297 N 
ATOM     10  C   LIG    1        4.372   1.241   2.226  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1        5.792   0.877   1.796  0.00  0.00    +0.038 C 
ATOM     12  C   LIG    1        5.958   0.659   0.275  0.00  0.00    +0.060 C 
ATOM     13  C   LIG    1        4.823   1.376  -0.471  0.00  0.00    +0.038 C 
ATOM     14  C   LIG    1        3.474   0.798  -0.042  0.00  0.00    +0.109 C 
BRANCH  12  15
ATOM     15  N   LIG    1        7.301   1.081  -0.171  0.00  0.00    -0.299 NA
ATOM     16  C   LIG    1        8.386   0.330   0.476  0.00  0.00    +0.085 C 
ATOM     17  C   LIG    1        9.602   0.697  -0.357  0.00  0.00    +0.017 C 
ATOM     18  C   LIG    1        9.054   0.976  -1.748  0.00  0.00    +0.017 C 
ATOM     19  C   LIG    1        7.540   0.898  -1.607  0.00  0.00    +0.085 C 
ENDBRANCH  12  15
ENDBRANCH   1   8
BRANCH   4  20
ATOM     20  C   LIG    1       -2.167  -1.923  -1.005  0.00  0.00    +0.265 C 
ATOM     21  N   LIG    1       -3.494  -1.733  -0.610  0.00  0.00    -0.296 N 
ATOM     22  C   LIG    1       -3.937  -1.441   0.749  0.00  0.00    +0.109 C 
ATOM     23  C   LIG    1       -4.920  -0.273   0.770  0.00  0.00    +0.038 C 
ATOM     24  C   LIG    1       -5.826  -0.230  -0.485  0.00  0.00    +0.060 C 
ATOM     25  C   LIG    1       -5.929  -1.624  -1.127  0.00  0.00    +0.038 C 
ATOM     26  C   LIG    1       -4.541  -2.110  -1.553  0.00  0.00    +0.109 C 
ATOM     27  O   LIG    1       -1.878  -2.515  -2.048  0.00  0.00    -0.268 OA
BRANCH  24  28
ATOM     28  N   LIG    1       -7.092   0.447  -0.169  0.00  0.00    -0.299 NA
ATOM     29  C   LIG    1       -8.092  -0.338   0.549  0.00  0.00    +0.085 C 
ATOM     30  C   LIG    1       -9.306   0.577   0.508  0.00  0.00    +0.017 C 
ATOM     31  C   LIG    1       -9.161   1.359  -0.793  0.00  0.00    +0.017 C 
ATOM     32  C   LIG    1       -7.789   0.984  -1.338  0.00  0.00    +0.085 C 
ENDBRANCH  24  28
ENDBRANCH   4  20
TORSDOF 4