REMARK  Name = BDB007701
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.847  -0.542  -1.907  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1       -0.875   0.369  -1.086  0.00  0.00    +0.244 C 
ATOM      3  N   LIG    1        0.258   0.940  -0.557  0.00  0.00    -0.309 N 
ATOM      4  H   LIG    1        0.215   1.742   0.056  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -2.185   0.887  -0.604  0.00  0.00    +0.043 A 
ATOM      6  C   LIG    1       -3.300   0.056  -0.731  0.00  0.00    +0.080 A 
ATOM      7  C   LIG    1       -4.521   0.529  -0.291  0.00  0.00    +0.216 A 
ATOM      8  N   LIG    1       -4.698   1.750   0.254  0.00  0.00    -0.221 NA
ATOM      9  C   LIG    1       -3.608   2.539   0.350  0.00  0.00    +0.115 A 
ATOM     10  C   LIG    1       -2.342   2.162  -0.062  0.00  0.00    +0.033 A 
BRANCH   7  11
ATOM     11  O   LIG    1       -5.590  -0.333  -0.427  0.00  0.00    -0.473 OA
BRANCH  11  12
ATOM     12  C   LIG    1       -6.865   0.191  -0.017  0.00  0.00    +0.178 C 
ATOM     13  C   LIG    1       -7.021   0.033   1.502  0.00  0.00    +0.060 C 
ATOM     14  C   LIG    1       -8.475  -0.190   1.891  0.00  0.00    +0.084 C 
ATOM     15  N   LIG    1       -9.058  -1.389   1.287  0.00  0.00    -0.316 NA
ATOM     16  H   LIG    1       -9.013  -2.169   1.942  0.00  0.00    +0.122 HD
ATOM     17  C   LIG    1       -8.428  -1.788   0.026  0.00  0.00    +0.084 C 
ATOM     18  C   LIG    1       -7.943  -0.591  -0.783  0.00  0.00    +0.060 C 
ENDBRANCH  11  12
ENDBRANCH   7  11
ENDBRANCH   2   5
BRANCH   3  19
ATOM     19  C   LIG    1        1.587   0.636  -1.070  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.657   0.960  -0.018  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.447   2.312   0.441  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        3.150   2.507   1.086  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        4.090   0.822  -0.578  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        4.443  -0.504  -1.111  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        5.782  -0.493  -1.734  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        6.938  -0.527  -0.755  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        6.768  -1.035   0.546  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        7.862  -1.090   1.420  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        9.122  -0.665   0.998  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        9.297  -0.179  -0.295  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        5.402  -1.461   1.024  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        8.212  -0.114  -1.169  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        4.389  -1.595  -0.123  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 8