REMARK  Name = BDB055351
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.135  -0.821   0.228  0.00  0.00    +0.066 A 
ATOM      2  N   LIG    1        1.408  -2.145   0.501  0.00  0.00    -0.319 N 
ATOM      3  H   LIG    1        0.658  -2.826   0.499  0.00  0.00    +0.169 HD
ATOM      4  C   LIG    1        2.671  -2.654   0.746  0.00  0.00    +0.273 A 
ATOM      5  O   LIG    1        2.836  -3.849   0.973  0.00  0.00    -0.266 OA
ATOM      6  C   LIG    1        3.729  -1.670   0.709  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        3.444  -0.344   0.450  0.00  0.00    -0.311 N 
ATOM      8  C   LIG    1        4.624   0.382   0.488  0.00  0.00    +0.049 A 
ATOM      9  C   LIG    1        5.653  -0.516   0.734  0.00  0.00    +0.026 A 
ATOM     10  C   LIG    1        5.089  -1.801   0.885  0.00  0.00    +0.033 A 
ATOM     11  C   LIG    1        2.139   0.074   0.204  0.00  0.00    +0.118 A 
ENDROOT
BRANCH   1  15
ATOM     12  C   LIG    1       -2.966   0.303  -0.469  0.00  0.00    -0.017 A 
ATOM     13  C   LIG    1       -1.970   0.570  -1.421  0.00  0.00    +0.007 A 
ATOM     14  C   LIG    1       -0.636   0.208  -1.198  0.00  0.00    +0.010 A 
ATOM     15  C   LIG    1       -0.262  -0.432  -0.013  0.00  0.00    -0.000 A 
ATOM     16  C   LIG    1       -1.247  -0.709   0.942  0.00  0.00    +0.010 A 
ATOM     17  C   LIG    1       -2.579  -0.345   0.717  0.00  0.00    +0.007 A 
BRANCH  12  19
ATOM     18  C   LIG    1       -4.914   1.677   0.363  0.00  0.00    +0.046 C 
ATOM     19  C   LIG    1       -4.424   0.695  -0.709  0.00  0.00    +0.085 C 
ATOM     20  C   LIG    1       -5.322  -0.548  -0.759  0.00  0.00    +0.046 C 
BRANCH  19  21
ATOM     21  O   LIG    1       -4.550   1.358  -1.974  0.00  0.00    -0.385 OA
ATOM     22  H   LIG    1       -5.487   1.583  -2.098  0.00  0.00    +0.211 HD
ENDBRANCH  19  21
ENDBRANCH  12  19
ENDBRANCH   1  15
BRANCH   8  23
ATOM     23  C   LIG    1        4.668   1.850   0.256  0.00  0.00    +0.209 C 
BRANCH  23  24
ATOM     24  O   LIG    1        5.872   2.351   0.818  0.00  0.00    -0.389 OA
ATOM     25  H   LIG    1        5.873   2.088   1.754  0.00  0.00    +0.210 HD
ENDBRANCH  23  24
ENDBRANCH   8  23
TORSDOF 5