REMARK  Name = BDB055354
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.639   0.704   2.089  0.00  0.00    +0.064 C 
ATOM      2  C   LIG    1        4.675   0.142   0.713  0.00  0.00    +0.021 A 
ATOM      3  N   LIG    1        3.536  -0.119  -0.026  0.00  0.00    -0.314 N 
ATOM      4  C   LIG    1        3.910  -0.630  -1.252  0.00  0.00    +0.111 A 
ATOM      5  C   LIG    1        2.909  -0.991  -2.229  0.00  0.00    +0.273 A 
ATOM      6  N   LIG    1        1.604  -0.775  -1.819  0.00  0.00    -0.319 N 
ATOM      7  H   LIG    1        0.892  -1.043  -2.486  0.00  0.00    +0.169 HD
ATOM      8  C   LIG    1        1.242  -0.268  -0.588  0.00  0.00    +0.066 A 
ATOM      9  O   LIG    1        3.150  -1.453  -3.340  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1        5.286  -0.697  -1.297  0.00  0.00    +0.033 A 
ATOM     11  C   LIG    1        2.196   0.061   0.301  0.00  0.00    +0.118 A 
ATOM     12  C   LIG    1        5.768  -0.211  -0.060  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1       -0.188  -0.089  -0.301  0.00  0.00    -0.000 A 
ATOM     14  C   LIG    1       -0.780  -0.683   0.815  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -2.145  -0.510   1.071  0.00  0.00    +0.007 A 
ATOM     16  C   LIG    1       -2.982   0.248   0.226  0.00  0.00    -0.012 A 
ATOM     17  C   LIG    1       -2.354   0.850  -0.883  0.00  0.00    +0.007 A 
ATOM     18  C   LIG    1       -0.989   0.681  -1.149  0.00  0.00    +0.010 A 
BRANCH  16  19
ATOM     19  C   LIG    1       -4.545   0.447   0.562  0.00  0.00    +0.137 C 
ATOM     20  C   LIG    1       -5.361  -0.852   0.837  0.00  0.00    +0.201 C 
ATOM     21  O   LIG    1       -6.156  -0.689  -0.355  0.00  0.00    -0.373 OA
ATOM     22  C   LIG    1       -5.536   0.583  -0.632  0.00  0.00    +0.201 C 
BRANCH  19  23
ATOM     23  O   LIG    1       -4.705   1.468   1.590  0.00  0.00    -0.379 OA
ATOM     24  H   LIG    1       -4.220   2.238   1.247  0.00  0.00    +0.211 HD
ENDBRANCH  19  23
ENDBRANCH  16  19
ENDBRANCH   8  13
TORSDOF 3