REMARK  Name = BDB062606
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   UNK A  1       -0.130  -2.223   0.676  0.00  0.00    -0.373 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   UNK A  1       -1.208  -3.140   0.891  0.00  0.00    +0.194 C 
BRANCH   2   3
ATOM      3  C   UNK A  1       -2.517  -2.734   0.207  0.00  0.00    +0.210 C 
BRANCH   3   5
ATOM      4  C   UNK A  0       -3.721  -0.647  -0.274  0.00  0.00    +0.401 C 
ATOM      5  N   UNK A  1       -2.902  -1.366   0.540  0.00  0.00    -0.266 N 
ATOM      6  H   UNK A  1       -2.902  -1.071   1.507  0.00  0.00    +0.153 HD
ATOM      7  O   UNK A  0       -4.051  -0.989  -1.398  0.00  0.00    -0.226 OA
BRANCH   4   8
ATOM      8  O   UNK A  0       -4.106   0.472   0.375  0.00  0.00    -0.445 OA
BRANCH   8  10
ATOM      9  C   UNK A  0       -6.369   0.786  -0.545  0.00  0.00    +0.055 C 
ATOM     10  C   UNK A  0       -5.005   1.421  -0.256  0.00  0.00    +0.107 C 
ATOM     11  C   UNK A  0       -5.193   2.533   0.788  0.00  0.00    +0.055 C 
ATOM     12  C   UNK A  0       -4.378   2.033  -1.514  0.00  0.00    +0.055 C 
ENDBRANCH   8  10
ENDBRANCH   4   8
ENDBRANCH   3   5
BRANCH   3  13
ATOM     13  C   UNK A  1       -3.612  -3.689   0.667  0.00  0.00    +0.328 C 
ATOM     14  O   UNK A  1       -4.420  -3.499   1.563  0.00  0.00    -0.249 OA
BRANCH  13  15
ATOM     15  O   UNK A  1       -3.595  -4.864   0.004  0.00  0.00    -0.479 OA
ATOM     16  H   UNK A  1       -4.359  -5.358   0.371  0.00  0.00    +0.295 HD
ENDBRANCH  13  15
ENDBRANCH   3  13
ENDBRANCH   2   3
ENDBRANCH   1   2
BRANCH   1  17
ATOM     17  C   UNK A  1        0.303  -2.154  -0.682  0.00  0.00    +0.195 C 
BRANCH  17  18
ATOM     18  C   UNK A  1        1.583  -1.357  -0.765  0.00  0.00    -0.022 A 
ATOM     19  C   UNK A  1        2.588  -1.729  -1.670  0.00  0.00    +0.006 A 
ATOM     20  C   UNK A  1        3.761  -0.977  -1.777  0.00  0.00    +0.012 A 
ATOM     21  C   UNK A  1        3.945   0.154  -0.976  0.00  0.00    +0.022 A 
ATOM     22  C   UNK A  1        2.935   0.555  -0.097  0.00  0.00    +0.012 A 
ATOM     23  C   UNK A  1        1.762  -0.198   0.005  0.00  0.00    +0.006 A 
BRANCH  21  24
ATOM     24  C   UNK A  1        5.204   0.927  -1.121  0.00  0.00    +0.193 C 
ATOM     25  O   UNK A  1        5.717   1.030  -2.233  0.00  0.00    -0.287 OA
BRANCH  24  26
ATOM     26  C   UNK A  1        5.858   1.573   0.045  0.00  0.00    +0.022 A 
ATOM     27  C   UNK A  1        5.828   0.995   1.321  0.00  0.00    +0.012 A 
ATOM     28  C   UNK A  1        6.468   1.629   2.388  0.00  0.00    +0.001 A 
ATOM     29  C   UNK A  1        7.148   2.829   2.182  0.00  0.00    +0.000 A 
ATOM     30  C   UNK A  1        7.198   3.397   0.909  0.00  0.00    +0.001 A 
ATOM     31  C   UNK A  1        6.559   2.767  -0.160  0.00  0.00    +0.012 A 
ENDBRANCH  24  26
ENDBRANCH  21  24
ENDBRANCH  17  18
ENDBRANCH   1  17
TORSDOF 11