REMARK  Name = BDB002717
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.950  -0.345   1.330  0.00  0.00    +0.266 C 
ATOM      2  N   LIG    1        2.289  -0.382   0.931  0.00  0.00    -0.236 N 
ATOM      3  C   LIG    1        2.877  -0.199  -0.312  0.00  0.00    +0.221 A 
ATOM      4  N   LIG    1        4.172  -0.399  -0.215  0.00  0.00    -0.113 NA
ATOM      5  N   LIG    1        4.478  -0.640   1.099  0.00  0.00    -0.136 NA
ATOM      6  C   LIG    1        3.354  -0.606   1.772  0.00  0.00    +0.233 A 
ATOM      7  O   LIG    1        0.735  -0.317   2.542  0.00  0.00    -0.267 OA
ENDROOT
BRANCH   1  11
ATOM      8  C   LIG    1       -3.482   1.604   0.114  0.00  0.00    +0.044 C 
ATOM      9  C   LIG    1       -2.372   0.630  -0.157  0.00  0.00    -0.050 A 
ATOM     10  C   LIG    1       -1.242   0.595   0.670  0.00  0.00    +0.016 A 
ATOM     11  C   LIG    1       -0.222  -0.333   0.430  0.00  0.00    +0.040 A 
ATOM     12  C   LIG    1       -0.347  -1.267  -0.603  0.00  0.00    +0.013 A 
ATOM     13  C   LIG    1       -1.477  -1.243  -1.420  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -2.483  -0.300  -1.198  0.00  0.00    +0.003 A 
ENDBRANCH   1  11
BRANCH   3  15
ATOM     15  N   LIG    1        2.227   0.164  -1.439  0.00  0.00    -0.327 N 
ATOM     16  H   LIG    1        1.435   0.800  -1.387  0.00  0.00    +0.145 HD
ATOM     17  H   LIG    1        2.849   0.425  -2.204  0.00  0.00    +0.145 HD
ENDBRANCH   3  15
TORSDOF 2