REMARK  Name = BDB055709
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.042   1.683   1.666  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1        0.788   1.476   0.498  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1        2.001   2.157   0.291  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1        2.440   3.068   1.262  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1        1.709   3.266   2.433  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.518   2.570   2.639  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   8
ATOM      7  O   LIG    1       -1.609   0.781   3.086  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -1.240   0.974   1.933  0.00  0.00    +0.245 C 
ATOM      9  N   LIG    1       -1.973   0.573   0.838  0.00  0.00    -0.303 N 
ATOM     10  H   LIG    1       -1.631   0.734  -0.099  0.00  0.00    +0.150 HD
BRANCH   9  11
ATOM     11  C   LIG    1       -3.213  -0.179   0.994  0.00  0.00    +0.121 C 
ATOM     12  C   LIG    1       -4.082  -0.091  -0.249  0.00  0.00    -0.014 A 
ATOM     13  C   LIG    1       -4.884  -1.184  -0.632  0.00  0.00    +0.042 A 
ATOM     14  C   LIG    1       -5.708  -1.099  -1.762  0.00  0.00    +0.013 A 
ATOM     15  C   LIG    1       -5.756   0.076  -2.509  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1       -4.997   1.177  -2.120  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -4.913  -2.438   0.173  0.00  0.00    +0.244 C 
ATOM     18  O   LIG    1       -5.679  -3.358  -0.085  0.00  0.00    -0.270 OA
ATOM     19  N   LIG    1       -4.049  -2.515   1.235  0.00  0.00    -0.309 N 
ATOM     20  H   LIG    1       -4.028  -3.424   1.683  0.00  0.00    +0.149 HD
ATOM     21  C   LIG    1       -4.175   1.100  -0.993  0.00  0.00    +0.006 A 
ATOM     22  C   LIG    1       -2.897  -1.651   1.333  0.00  0.00    +0.131 C 
ENDBRANCH   9  11
ENDBRANCH   1   8
BRANCH   3  23
ATOM     23  C   LIG    1        2.801   1.953  -0.977  0.00  0.00    +0.093 C 
BRANCH  23  24
ATOM     24  C   LIG    1        2.988   0.487  -1.348  0.00  0.00    +0.074 A 
ATOM     25  C   LIG    1        4.006  -0.336  -0.646  0.00  0.00    +0.011 A 
ATOM     26  C   LIG    1        4.122  -1.669  -1.034  0.00  0.00    +0.050 A 
ATOM     27  C   LIG    1        5.057  -2.513  -0.421  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1        5.879  -2.018   0.589  0.00  0.00    +0.001 A 
ATOM     29  C   LIG    1        5.766  -0.686   0.984  0.00  0.00    +0.001 A 
ATOM     30  C   LIG    1        3.247  -2.187  -2.097  0.00  0.00    +0.272 A 
ATOM     31  O   LIG    1        3.317  -3.351  -2.475  0.00  0.00    -0.266 OA
ATOM     32  N   LIG    1        2.352  -1.293  -2.633  0.00  0.00    -0.242 N 
ATOM     33  H   LIG    1        1.748  -1.633  -3.374  0.00  0.00    +0.192 HD
ATOM     34  C   LIG    1        4.833   0.157   0.371  0.00  0.00    +0.010 A 
ATOM     35  N   LIG    1        2.214   0.012  -2.281  0.00  0.00    -0.175 NA
ENDBRANCH  23  24
ENDBRANCH   3  23
TORSDOF 4