REMARK  Name = BDB058007
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.002  -1.823   0.671  0.00  0.00    -0.021 A 
ATOM      2  C   LIG    1        1.438  -0.549   0.508  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        0.191  -0.399  -0.104  0.00  0.00    +0.013 A 
ATOM      4  C   LIG    1       -0.508  -1.531  -0.533  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        0.047  -2.804  -0.385  0.00  0.00    +0.013 A 
ATOM      6  C   LIG    1        1.294  -2.948   0.229  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  13
ATOM      7  C   LIG    1        6.419   0.923  -0.891  0.00  0.00    +0.079 A 
ATOM      8  C   LIG    1        5.844  -0.010  -0.047  0.00  0.00    +0.152 A 
ATOM      9  O   LIG    1        4.527  -0.414  -0.035  0.00  0.00    -0.451 OA
ATOM     10  C   LIG    1        4.417  -1.356   0.981  0.00  0.00    +0.176 C 
ATOM     11  C   LIG    1        5.727  -1.568   1.646  0.00  0.00    +0.231 C 
ATOM     12  O   LIG    1        6.010  -2.312   2.559  0.00  0.00    -0.283 OA
ATOM     13  C   LIG    1        3.301  -2.012   1.323  0.00  0.00    +0.058 C 
ATOM     14  C   LIG    1        6.608  -0.654   0.928  0.00  0.00    +0.068 A 
ATOM     15  C   LIG    1        7.954  -0.409   1.115  0.00  0.00    +0.015 A 
ATOM     16  C   LIG    1        8.549   0.531   0.275  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1        7.791   1.190  -0.715  0.00  0.00    +0.017 A 
BRANCH   7  21
ATOM     18  N   LIG    1        4.383   1.314  -2.195  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1        3.911   1.781  -2.958  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1        3.908   0.550  -1.732  0.00  0.00    +0.145 HD
ATOM     21  C   LIG    1        5.684   1.652  -1.957  0.00  0.00    +0.245 C 
ATOM     22  O   LIG    1        6.229   2.528  -2.618  0.00  0.00    -0.270 OA
ENDBRANCH   7  21
ENDBRANCH   1  13
BRANCH   4  23
ATOM     23  C   LIG    1       -1.814  -1.395  -1.212  0.00  0.00    +0.247 C 
ATOM     24  N   LIG    1       -2.867  -0.768  -0.539  0.00  0.00    -0.288 N 
ATOM     25  C   LIG    1       -2.936  -0.756   0.931  0.00  0.00    +0.184 C 
ATOM     26  C   LIG    1       -4.027   0.127   1.419  0.00  0.00    +0.151 A 
ATOM     27  N   LIG    1       -4.281   0.479   2.659  0.00  0.00    -0.133 NA
ATOM     28  N   LIG    1       -5.383   1.300   2.642  0.00  0.00    -0.134 NA
ATOM     29  C   LIG    1       -5.785   1.438   1.394  0.00  0.00    +0.137 A 
ATOM     30  N   LIG    1       -4.966   0.695   0.595  0.00  0.00    -0.312 N 
ATOM     31  C   LIG    1       -4.960   0.520  -0.836  0.00  0.00    +0.144 C 
ATOM     32  C   LIG    1       -4.153  -0.712  -1.237  0.00  0.00    +0.130 C 
ATOM     33  O   LIG    1       -1.909  -1.837  -2.353  0.00  0.00    -0.270 OA
BRANCH  29  34
ATOM     34  C   LIG    1       -7.000   2.347   1.051  0.00  0.00    +0.057 C 
ATOM     35  C   LIG    1       -8.125   1.823   0.201  0.00  0.00    +0.012 C 
ATOM     36  C   LIG    1       -7.242   2.927  -0.313  0.00  0.00    +0.012 C 
ENDBRANCH  29  34
ENDBRANCH   4  23
TORSDOF 4