REMARK  Name = BDB020911
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.902  -2.488  -1.017  0.00  0.00    +0.009 A 
ATOM      2  C   LIG    1       -0.570  -3.048  -1.298  0.00  0.00    -0.001 A 
ATOM      3  C   LIG    1       -0.453  -4.329  -1.697  0.00  0.00    +0.079 A 
ATOM      4  C   LIG    1       -1.642  -5.201  -1.867  0.00  0.00    +0.252 A 
ATOM      5  O   LIG    1       -1.483  -6.357  -2.246  0.00  0.00    -0.268 OA
ATOM      6  N   LIG    1       -2.864  -4.615  -1.569  0.00  0.00    -0.318 N 
ATOM      7  C   LIG    1       -4.082  -5.398  -1.712  0.00  0.00    +0.152 C 
ATOM      8  C   LIG    1       -2.971  -3.297  -1.161  0.00  0.00    +0.098 A 
ENDROOT
BRANCH   2   9
ATOM      9  C   LIG    1        0.693  -2.309  -1.129  0.00  0.00    +0.019 A 
ATOM     10  C   LIG    1        1.496  -1.939  -2.191  0.00  0.00    +0.126 A 
ATOM     11  N   LIG    1        2.652  -1.258  -2.061  0.00  0.00    -0.203 NA
ATOM     12  C   LIG    1        3.009  -0.933  -0.810  0.00  0.00    +0.318 A 
ATOM     13  N   LIG    1        2.317  -1.240   0.301  0.00  0.00    -0.203 NA
ATOM     14  C   LIG    1        1.167  -1.920   0.110  0.00  0.00    +0.126 A 
BRANCH  12  15
ATOM     15  O   LIG    1        4.194  -0.239  -0.714  0.00  0.00    -0.462 OA
BRANCH  15  16
ATOM     16  C   LIG    1        4.510   0.159   0.618  0.00  0.00    +0.233 C 
BRANCH  16  17
ATOM     17  C   LIG    1        5.821   0.947   0.604  0.00  0.00    +0.056 C 
BRANCH  17  18
ATOM     18  C   LIG    1        5.679   2.266  -0.171  0.00  0.00    +0.087 C 
BRANCH  18  19
ATOM     19  N   LIG    1        6.870   3.128  -0.223  0.00  0.00    -0.308 NA
ATOM     20  C   LIG    1        7.981   2.514  -0.943  0.00  0.00    +0.104 C 
ATOM     21  C   LIG    1        7.292   3.604   1.091  0.00  0.00    +0.104 C 
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH  12  15
ENDBRANCH   2   9
BRANCH   1  25
ATOM     22  N   LIG    1       -2.680   0.674   0.501  0.00  0.00    -0.264 N 
ATOM     23  N   LIG    1       -2.001   1.153  -0.565  0.00  0.00    -0.178 NA
ATOM     24  C   LIG    1       -1.639   0.057  -1.236  0.00  0.00    +0.143 A 
ATOM     25  C   LIG    1       -2.077  -1.127  -0.607  0.00  0.00    +0.022 A 
ATOM     26  C   LIG    1       -2.748  -0.697   0.516  0.00  0.00    +0.117 A 
BRANCH  22  28
ATOM     27  C   LIG    1       -2.517   2.913   1.631  0.00  0.00    +0.038 C 
ATOM     28  C   LIG    1       -3.252   1.574   1.509  0.00  0.00    +0.134 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -4.743   1.765   1.273  0.00  0.00    -0.023 A 
ATOM     30  C   LIG    1       -5.666   1.408   2.270  0.00  0.00    +0.006 A 
ATOM     31  C   LIG    1       -7.036   1.585   2.067  0.00  0.00    +0.000 A 
ATOM     32  C   LIG    1       -7.501   2.121   0.868  0.00  0.00    +0.000 A 
ATOM     33  C   LIG    1       -6.598   2.483  -0.129  0.00  0.00    +0.000 A 
ATOM     34  C   LIG    1       -5.228   2.309   0.072  0.00  0.00    +0.006 A 
ENDBRANCH  28  29
ENDBRANCH  22  28
ENDBRANCH   1  25
TORSDOF 9