REMARK  Name = BDB007650
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.371   0.661   1.488  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        0.887   0.816   0.386  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1        0.152   1.081  -0.748  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1        0.595   1.024  -1.655  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        2.357   0.662   0.212  0.00  0.00    +0.037 A 
ATOM      6  C   LIG    1        3.053  -0.143   1.121  0.00  0.00    +0.016 A 
ATOM      7  C   LIG    1        4.437  -0.320   1.000  0.00  0.00    +0.046 A 
ATOM      8  C   LIG    1        5.137   0.317  -0.024  0.00  0.00    +0.121 A 
ATOM      9  C   LIG    1        4.440   1.130  -0.923  0.00  0.00    +0.046 A 
ATOM     10  C   LIG    1        3.059   1.310  -0.808  0.00  0.00    +0.016 A 
BRANCH   8  11
ATOM     11  O   LIG    1        6.479   0.231  -0.263  0.00  0.00    -0.488 OA
BRANCH  11  12
ATOM     12  C   LIG    1        7.298  -0.481   0.668  0.00  0.00    +0.188 C 
ATOM     13  C   LIG    1        8.761  -0.064   0.453  0.00  0.00    +0.125 C 
ATOM     14  N   LIG    1        9.416  -1.183  -0.248  0.00  0.00    -0.312 NA
ATOM     15  H   LIG    1        9.181  -1.106  -1.240  0.00  0.00    +0.122 HD
ATOM     16  C   LIG    1        8.751  -2.371   0.291  0.00  0.00    +0.084 C 
ATOM     17  C   LIG    1        7.287  -1.980   0.365  0.00  0.00    +0.061 C 
ENDBRANCH  11  12
ENDBRANCH   8  11
ENDBRANCH   2   5
BRANCH   3  18
ATOM     18  C   LIG    1       -1.297   1.269  -0.716  0.00  0.00    +0.137 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.068  -0.034  -0.421  0.00  0.00    +0.145 C 
BRANCH  19  20
ATOM     20  O   LIG    1       -2.074  -0.352   0.976  0.00  0.00    -0.389 OA
ATOM     21  H   LIG    1       -1.213  -0.053   1.343  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1       -3.523   0.013  -0.954  0.00  0.00    +0.117 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -4.290   1.242  -0.650  0.00  0.00    -0.295 NA
ATOM     24  C   LIG    1       -5.589   1.248  -1.355  0.00  0.00    +0.120 C 
ATOM     25  C   LIG    1       -6.660   0.368  -0.745  0.00  0.00    -0.030 A 
ATOM     26  C   LIG    1       -6.597  -0.015   0.608  0.00  0.00    -0.042 A 
ATOM     27  C   LIG    1       -7.618  -0.801   1.157  0.00  0.00    +0.004 A 
ATOM     28  C   LIG    1       -8.708  -1.186   0.377  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1       -8.784  -0.792  -0.958  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -5.403   0.364   1.450  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1       -7.767  -0.017  -1.515  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1       -4.537   1.447   0.790  0.00  0.00    +0.089 C 
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   3  18
TORSDOF 8