REMARK  Name = BDB064754
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.606   1.029  -0.875  0.00  0.00    +0.076 A 
ATOM      2  C   LIG    1        0.663   1.521  -2.187  0.00  0.00    +0.138 A 
ATOM      3  C   LIG    1       -0.477   1.585  -2.984  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1       -1.697   1.145  -2.467  0.00  0.00    +0.011 A 
ATOM      5  C   LIG    1       -1.778   0.632  -1.165  0.00  0.00    -0.023 A 
ATOM      6  C   LIG    1       -0.620   0.589  -0.371  0.00  0.00    +0.035 A 
ENDROOT
BRANCH   1   9
ATOM      7  O   LIG    1        1.172   0.283   1.964  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        2.019   0.628   1.149  0.00  0.00    +0.241 C 
ATOM      9  N   LIG    1        1.816   1.012  -0.152  0.00  0.00    -0.279 N 
ATOM     10  H   LIG    1        2.601   1.381  -0.680  0.00  0.00    +0.155 HD
BRANCH   8  11
ATOM     11  C   LIG    1        3.435   0.723   1.597  0.00  0.00    +0.068 C 
ATOM     12  C   LIG    1        4.484   0.405   0.823  0.00  0.00    +0.013 C 
BRANCH  12  13
ATOM     13  C   LIG    1        5.879   0.468   1.279  0.00  0.00    -0.025 A 
ATOM     14  C   LIG    1        6.264   0.081   2.569  0.00  0.00    +0.008 A 
ATOM     15  C   LIG    1        7.606   0.130   2.955  0.00  0.00    +0.001 A 
ATOM     16  C   LIG    1        8.578   0.556   2.052  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1        8.210   0.928   0.761  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1        6.868   0.879   0.375  0.00  0.00    +0.008 A 
ENDBRANCH  12  13
ENDBRANCH   8  11
ENDBRANCH   1   9
BRANCH   2  19
ATOM     19  O   LIG    1        1.876   1.946  -2.671  0.00  0.00    -0.505 OA
ATOM     20  H   LIG    1        1.744   2.270  -3.578  0.00  0.00    +0.292 HD
ENDBRANCH   2  19
BRANCH   5  21
ATOM     21  C   LIG    1       -3.049   0.185  -0.577  0.00  0.00    +0.008 C 
ATOM     22  C   LIG    1       -3.993  -0.491  -1.252  0.00  0.00    +0.009 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -5.253  -0.944  -0.645  0.00  0.00    -0.018 A 
ATOM     24  C   LIG    1       -5.294  -1.521   0.633  0.00  0.00    +0.053 A 
ATOM     25  C   LIG    1       -6.507  -1.964   1.157  0.00  0.00    +0.121 A 
ATOM     26  C   LIG    1       -7.683  -1.852   0.427  0.00  0.00    +0.090 A 
ATOM     27  C   LIG    1       -7.640  -1.295  -0.844  0.00  0.00    +0.121 A 
ATOM     28  C   LIG    1       -6.438  -0.846  -1.389  0.00  0.00    +0.053 A 
BRANCH  25  29
ATOM     29  O   LIG    1       -6.579  -2.526   2.399  0.00  0.00    -0.507 OA
ATOM     30  H   LIG    1       -5.689  -2.538   2.788  0.00  0.00    +0.292 HD
ENDBRANCH  25  29
BRANCH  27  31
ATOM     31  O   LIG    1       -8.811  -1.203  -1.538  0.00  0.00    -0.507 OA
ATOM     32  H   LIG    1       -8.635  -0.784  -2.396  0.00  0.00    +0.292 HD
ENDBRANCH  27  31
ENDBRANCH  22  23
ENDBRANCH   5  21
TORSDOF 8