REMARK  Name = BDB007730
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.813  -0.539   1.671  0.00  0.00    -0.269 OA
ATOM      2  C   LIG    1        0.851  -0.661   0.452  0.00  0.00    +0.263 C 
ATOM      3  N   LIG    1       -0.197  -1.149  -0.293  0.00  0.00    -0.308 N 
ATOM      4  H   LIG    1       -0.029  -1.248  -1.291  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.058  -0.270  -0.343  0.00  0.00    +0.132 A 
ATOM      6  N   LIG    1        1.977  -0.462  -1.684  0.00  0.00    -0.231 NA
ATOM      7  C   LIG    1        3.069  -0.106  -2.368  0.00  0.00    +0.225 A 
ATOM      8  N   LIG    1        4.193   0.404  -1.849  0.00  0.00    -0.201 NA
ATOM      9  C   LIG    1        4.205   0.568  -0.514  0.00  0.00    +0.219 A 
ATOM     10  C   LIG    1        3.155   0.245   0.304  0.00  0.00    +0.100 A 
BRANCH   9  11
ATOM     11  O   LIG    1        5.323   1.082   0.112  0.00  0.00    -0.473 OA
BRANCH  11  12
ATOM     12  C   LIG    1        6.412   1.445  -0.754  0.00  0.00    +0.178 C 
ATOM     13  C   LIG    1        7.249   2.500  -0.014  0.00  0.00    +0.060 C 
ATOM     14  C   LIG    1        8.401   1.853   0.746  0.00  0.00    +0.084 C 
ATOM     15  N   LIG    1        9.336   1.167  -0.148  0.00  0.00    -0.316 NA
ATOM     16  H   LIG    1        9.851   0.466   0.385  0.00  0.00    +0.122 HD
ATOM     17  C   LIG    1        8.706   0.551  -1.315  0.00  0.00    +0.084 C 
ATOM     18  C   LIG    1        7.242   0.198  -1.091  0.00  0.00    +0.060 C 
ENDBRANCH  11  12
ENDBRANCH   9  11
ENDBRANCH   2   5
BRANCH   3  19
ATOM     19  C   LIG    1       -1.415  -1.710   0.279  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.293  -0.661   0.991  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.795  -0.398   2.312  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -0.816  -0.356   2.248  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -3.755  -1.142   1.142  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.463  -1.433  -0.122  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -5.782  -2.045   0.139  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -6.868  -1.079   0.567  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.773   0.294   0.274  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -7.808   1.160   0.652  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -8.941   0.664   1.296  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -9.046  -0.697   1.571  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -5.533   0.845  -0.386  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -8.017  -1.565   1.206  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -4.647  -0.255  -0.987  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 8