REMARK  Name = BDB007533
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.121  -2.095   0.761  0.00  0.00    -0.269 OA
ATOM      2  C   LIG    1       -0.247  -2.038  -0.457  0.00  0.00    +0.263 C 
ATOM      3  N   LIG    1        0.801  -2.202  -1.337  0.00  0.00    -0.308 N 
ATOM      4  H   LIG    1        0.530  -2.219  -2.319  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -1.567  -1.766  -1.111  0.00  0.00    +0.127 A 
ATOM      6  N   LIG    1       -1.566  -1.751  -2.472  0.00  0.00    -0.250 NA
ATOM      7  C   LIG    1       -2.760  -1.525  -3.052  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1       -3.938  -1.302  -2.348  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1       -3.916  -1.282  -0.953  0.00  0.00    +0.031 A 
ATOM     10  C   LIG    1       -2.696  -1.556  -0.329  0.00  0.00    +0.056 A 
BRANCH   9  11
ATOM     11  N   LIG    1       -5.052  -1.137  -0.156  0.00  0.00    -0.341 N 
ATOM     12  H   LIG    1       -4.825  -0.849   0.795  0.00  0.00    +0.146 HD
BRANCH  11  13
ATOM     13  C   LIG    1       -6.295  -0.536  -0.657  0.00  0.00    +0.075 C 
ATOM     14  C   LIG    1       -6.125   0.978  -0.833  0.00  0.00    +0.050 C 
ATOM     15  C   LIG    1       -7.466   1.675  -0.693  0.00  0.00    +0.161 C 
ATOM     16  O   LIG    1       -8.057   1.491   0.592  0.00  0.00    -0.380 OA
ATOM     17  C   LIG    1       -7.686   0.292   1.272  0.00  0.00    +0.161 C 
ATOM     18  C   LIG    1       -7.438  -0.865   0.318  0.00  0.00    +0.050 C 
ENDBRANCH  11  13
ENDBRANCH   9  11
ENDBRANCH   2   5
BRANCH   3  19
ATOM     19  C   LIG    1        2.126  -2.663  -0.956  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.915  -1.738   0.001  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.461  -1.917   1.347  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        1.478  -1.894   1.325  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        2.843  -0.250  -0.428  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.778   0.713   0.185  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        5.175   0.485  -0.213  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        6.144   1.460   0.427  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        5.799   2.151   1.602  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        6.723   3.023   2.195  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        7.991   3.187   1.639  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        8.344   2.489   0.487  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        4.414   2.003   2.183  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        7.427   1.627  -0.116  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        3.678   0.766   1.649  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 8