REMARK  Name = BDB056575
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.249  -1.061   0.425  0.00  0.00    +0.125 A 
ATOM      2  N   LIG    1       -0.784  -2.162   1.058  0.00  0.00    -0.239 NA
ATOM      3  C   LIG    1        0.549  -2.344   1.237  0.00  0.00    +0.123 A 
ATOM      4  C   LIG    1        1.463  -1.407   0.751  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1        0.968  -0.295   0.080  0.00  0.00    +0.052 A 
ATOM      6  N   LIG    1        2.049   0.455  -0.317  0.00  0.00    -0.354 N 
ATOM      7  H   LIG    1        1.977   1.318  -0.834  0.00  0.00    +0.166 HD
ATOM      8  C   LIG    1        3.220  -0.131   0.094  0.00  0.00    +0.053 A 
ATOM      9  C   LIG    1        2.881  -1.291   0.759  0.00  0.00    +0.037 A 
ATOM     10  C   LIG    1       -0.401  -0.094  -0.106  0.00  0.00    +0.070 A 
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        4.649   0.433  -0.163  0.00  0.00    +0.063 A 
ATOM     12  C   LIG    1        4.959   1.595  -0.835  0.00  0.00    +0.144 A 
ATOM     13  C   LIG    1        4.195   2.661  -1.508  0.00  0.00    +0.090 C 
ATOM     14  O   LIG    1        6.310   1.752  -0.853  0.00  0.00    -0.359 OA
ATOM     15  N   LIG    1        6.911   0.700  -0.197  0.00  0.00    -0.083 NA
ATOM     16  C   LIG    1        5.914  -0.093   0.218  0.00  0.00    +0.090 A 
ATOM     17  C   LIG    1        6.243  -1.326   0.967  0.00  0.00    +0.070 C 
ENDBRANCH   8  11
BRANCH   1  18
ATOM     18  N   LIG    1       -2.634  -0.997   0.298  0.00  0.00    -0.297 N 
ATOM     19  H   LIG    1       -3.053  -1.865   0.622  0.00  0.00    +0.154 HD
BRANCH  18  21
ATOM     20  C   LIG    1       -4.913  -0.283  -0.131  0.00  0.00    +0.141 A 
ATOM     21  C   LIG    1       -3.581   0.046   0.222  0.00  0.00    +0.075 A 
ATOM     22  C   LIG    1       -3.259   1.393   0.426  0.00  0.00    +0.027 A 
ATOM     23  C   LIG    1       -4.225   2.393   0.286  0.00  0.00    +0.002 A 
ATOM     24  C   LIG    1       -5.529   2.059  -0.065  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -5.876   0.724  -0.271  0.00  0.00    +0.047 A 
BRANCH  20  27
ATOM     26  C   LIG    1       -6.455  -2.001  -0.748  0.00  0.00    +0.277 C 
ATOM     27  O   LIG    1       -5.160  -1.627  -0.297  0.00  0.00    -0.493 OA
ENDBRANCH  20  27
ENDBRANCH  18  21
ENDBRANCH   1  18
TORSDOF 4