REMARK  Name = BDB056275
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.901   0.421  -1.057  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.009   1.485  -1.013  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1        1.197   1.352  -0.294  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1        1.481   0.144   0.352  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        0.575  -0.921   0.310  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1       -0.613  -0.788  -0.410  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1       -2.024   0.957  -3.015  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -2.140   0.580  -1.851  0.00  0.00    +0.247 C 
ATOM      9  N   LIG    1       -3.367   0.294  -1.259  0.00  0.00    -0.297 N 
ATOM     10  C   LIG    1       -3.591   0.164   0.184  0.00  0.00    +0.109 C 
ATOM     11  C   LIG    1       -4.907   0.812   0.602  0.00  0.00    +0.038 C 
ATOM     12  C   LIG    1       -6.139   0.210  -0.123  0.00  0.00    +0.060 C 
ATOM     13  C   LIG    1       -5.710  -0.434  -1.463  0.00  0.00    +0.038 C 
ATOM     14  C   LIG    1       -4.554   0.319  -2.105  0.00  0.00    +0.109 C 
BRANCH  12  15
ATOM     15  N   LIG    1       -6.864  -0.737   0.765  0.00  0.00    -0.299 NA
ATOM     16  C   LIG    1       -7.588  -0.033   1.846  0.00  0.00    +0.085 C 
ATOM     17  C   LIG    1       -8.962   0.322   1.287  0.00  0.00    +0.017 C 
ATOM     18  C   LIG    1       -9.139  -0.572   0.070  0.00  0.00    +0.017 C 
ATOM     19  C   LIG    1       -7.940  -1.503   0.110  0.00  0.00    +0.085 C 
ENDBRANCH  12  15
ENDBRANCH   1   8
BRANCH   4  20
ATOM     20  C   LIG    1        2.724  -0.013   1.134  0.00  0.00    +0.247 C 
ATOM     21  N   LIG    1        3.925   0.005   0.454  0.00  0.00    -0.296 N 
ATOM     22  C   LIG    1        5.181  -0.214   1.160  0.00  0.00    +0.127 C 
ATOM     23  C   LIG    1        6.172  -0.660   0.065  0.00  0.00    +0.075 C 
ATOM     24  C   LIG    1        5.635   0.081  -1.169  0.00  0.00    +0.039 C 
ATOM     25  C   LIG    1        4.125  -0.020  -0.988  0.00  0.00    +0.109 C 
ATOM     26  O   LIG    1        2.626  -0.171   2.347  0.00  0.00    -0.270 OA
BRANCH  23  27
ATOM     27  N   LIG    1        7.591  -0.519   0.388  0.00  0.00    -0.298 NA
ATOM     28  C   LIG    1        8.493  -0.973  -0.669  0.00  0.00    +0.085 C 
ATOM     29  C   LIG    1        9.851  -0.550  -0.136  0.00  0.00    +0.017 C 
ATOM     30  C   LIG    1        9.574   0.705   0.682  0.00  0.00    +0.017 C 
ATOM     31  C   LIG    1        8.055   0.816   0.757  0.00  0.00    +0.085 C 
ENDBRANCH  23  27
ENDBRANCH   4  20
TORSDOF 4