REMARK  Name = BDB008375
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.302   0.598  -0.140  0.00  0.00    -0.278 N 
ATOM      2  H   LIG    1        0.845  -0.261  -0.040  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        1.009   1.747  -0.423  0.00  0.00    +0.253 C 
ATOM      4  O   LIG    1        0.529   2.864  -0.578  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   6
ATOM      5  C   LIG    1       -1.554  -0.864   0.318  0.00  0.00    +0.143 A 
ATOM      6  C   LIG    1       -1.089   0.435   0.033  0.00  0.00    +0.077 A 
ATOM      7  C   LIG    1       -2.008   1.480  -0.063  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1       -3.381   1.242   0.123  0.00  0.00    +0.002 A 
ATOM      9  C   LIG    1       -3.848  -0.057   0.408  0.00  0.00    +0.075 A 
ATOM     10  N   LIG    1       -5.152  -0.328   0.592  0.00  0.00    -0.255 NA
ATOM     11  C   LIG    1       -6.033   0.693   0.497  0.00  0.00    +0.111 A 
ATOM     12  C   LIG    1       -5.673   1.998   0.222  0.00  0.00    +0.020 A 
ATOM     13  C   LIG    1       -4.325   2.274   0.032  0.00  0.00    +0.011 A 
ATOM     14  C   LIG    1       -2.924  -1.087   0.501  0.00  0.00    +0.075 A 
BRANCH   5  16
ATOM     15  C   LIG    1       -1.016  -3.161   0.682  0.00  0.00    +0.277 C 
ATOM     16  O   LIG    1       -0.585  -1.837   0.396  0.00  0.00    -0.493 OA
ENDBRANCH   5  16
ENDBRANCH   1   6
BRANCH   3  17
ATOM     17  C   LIG    1        2.446   1.549  -0.536  0.00  0.00    +0.101 A 
ATOM     18  C   LIG    1        3.178   0.383  -0.398  0.00  0.00    +0.168 A 
ATOM     19  N   LIG    1        4.520   0.735  -0.601  0.00  0.00    -0.217 N 
ATOM     20  C   LIG    1        5.523  -0.224  -0.530  0.00  0.00    +0.161 A 
ATOM     21  C   LIG    1        5.219  -1.500  -0.266  0.00  0.00    +0.153 A 
ATOM     22  C   LIG    1        3.761  -1.778  -0.064  0.00  0.00    +0.160 A 
ATOM     23  N   LIG    1        4.660   2.056  -0.857  0.00  0.00    -0.173 NA
ATOM     24  N   LIG    1        2.796  -0.907  -0.123  0.00  0.00    -0.232 NA
ATOM     25  C   LIG    1        3.415   2.534  -0.816  0.00  0.00    +0.150 A 
BRANCH  21  26
ATOM     26  O   LIG    1        6.169  -2.488  -0.183  0.00  0.00    -0.504 OA
ATOM     27  H   LIG    1        5.731  -3.333   0.016  0.00  0.00    +0.292 HD
ENDBRANCH  21  26
ENDBRANCH   3  17
TORSDOF 4