REMARK  Name = BDB056264
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.322  -1.490  -3.101  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.443  -0.961  -4.053  0.00  0.00    +0.014 A 
ATOM      3  C   LIG    1       -0.936  -1.063  -3.857  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1       -1.430  -1.694  -2.709  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1       -0.551  -2.267  -1.782  0.00  0.00    +0.014 A 
ATOM      6  C   LIG    1        0.828  -2.165  -1.978  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1        5.493   0.464  -0.457  0.00  0.00    +0.009 C 
ATOM      8  C   LIG    1        4.087   1.003  -0.800  0.00  0.00    +0.024 C 
ATOM      9  C   LIG    1        3.113  -0.105  -1.189  0.00  0.00    +0.108 C 
ATOM     10  N   LIG    1        3.599  -0.876  -2.337  0.00  0.00    -0.298 N 
ATOM     11  C   LIG    1        2.780  -1.387  -3.343  0.00  0.00    +0.247 C 
ATOM     12  O   LIG    1        3.206  -1.766  -4.432  0.00  0.00    -0.270 OA
ATOM     13  C   LIG    1        5.041  -0.897  -2.561  0.00  0.00    +0.108 C 
ATOM     14  C   LIG    1        5.805  -0.829  -1.245  0.00  0.00    +0.024 C 
BRANCH   7  17
ATOM     15  C   LIG    1        6.125   2.623   1.533  0.00  0.00    +0.105 C 
ATOM     16  N   LIG    1        5.462   1.390   1.966  0.00  0.00    -0.302 NA
ATOM     17  C   LIG    1        5.677   0.234   1.065  0.00  0.00    +0.060 C 
ATOM     18  C   LIG    1        7.062  -0.293   1.454  0.00  0.00    +0.020 C 
ATOM     19  C   LIG    1        7.231   0.091   2.919  0.00  0.00    +0.017 C 
ATOM     20  C   LIG    1        6.010   0.936   3.255  0.00  0.00    +0.084 C 
ENDBRANCH   7  17
ENDBRANCH   1  11
BRANCH   4  21
ATOM     21  C   LIG    1       -2.897  -1.808  -2.535  0.00  0.00    +0.247 C 
ATOM     22  N   LIG    1       -3.468  -1.405  -1.329  0.00  0.00    -0.298 N 
ATOM     23  C   LIG    1       -4.897  -1.636  -1.145  0.00  0.00    +0.108 C 
ATOM     24  C   LIG    1       -5.279  -1.656   0.331  0.00  0.00    +0.024 C 
ATOM     25  C   LIG    1       -4.907  -0.346   1.064  0.00  0.00    +0.009 C 
ATOM     26  C   LIG    1       -3.789   0.412   0.317  0.00  0.00    +0.024 C 
ATOM     27  C   LIG    1       -2.803  -0.540  -0.351  0.00  0.00    +0.108 C 
ATOM     28  O   LIG    1       -3.550  -2.264  -3.472  0.00  0.00    -0.270 OA
BRANCH  25  29
ATOM     29  C   LIG    1       -6.141   0.561   1.315  0.00  0.00    +0.060 C 
ATOM     30  N   LIG    1       -5.758   1.794   2.051  0.00  0.00    -0.302 NA
ATOM     31  C   LIG    1       -6.044   2.994   1.261  0.00  0.00    +0.105 C 
ATOM     32  C   LIG    1       -6.514   1.811   3.313  0.00  0.00    +0.084 C 
ATOM     33  C   LIG    1       -7.754   0.986   3.049  0.00  0.00    +0.017 C 
ATOM     34  C   LIG    1       -7.212  -0.124   2.177  0.00  0.00    +0.020 C 
ENDBRANCH  25  29
ENDBRANCH   4  21
TORSDOF 4