REMARK  Name = BDB057907
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.221  -0.844  -0.227  0.00  0.00    +0.093 A 
ATOM      2  N   LIG    1        0.605  -2.122  -0.469  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1        1.922  -2.409  -0.458  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1        2.904  -1.472  -0.215  0.00  0.00    +0.035 A 
ATOM      5  C   LIG    1        2.501  -0.162   0.032  0.00  0.00    +0.062 A 
ATOM      6  C   LIG    1        1.142   0.164   0.028  0.00  0.00    +0.045 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1       -4.319   1.168  -0.054  0.00  0.00    +0.174 C 
ATOM      8  N   LIG    1       -3.181   0.296  -0.173  0.00  0.00    -0.254 N 
ATOM      9  N   LIG    1       -3.359  -1.003  -0.448  0.00  0.00    -0.065 NA
ATOM     10  N   LIG    1       -2.157  -1.563  -0.499  0.00  0.00    -0.128 NA
ATOM     11  C   LIG    1       -1.214  -0.594  -0.251  0.00  0.00    +0.131 A 
ATOM     12  C   LIG    1       -1.862   0.607  -0.040  0.00  0.00    +0.139 A 
ENDBRANCH   1  11
BRANCH   5  13
ATOM     13  C   LIG    1        3.547   0.851   0.295  0.00  0.00    +0.337 C 
ATOM     14  O   LIG    1        4.746   0.646   0.316  0.00  0.00    -0.245 OA
BRANCH  13  15
ATOM     15  O   LIG    1        3.042   2.077   0.519  0.00  0.00    -0.477 OA
ATOM     16  H   LIG    1        3.835   2.632   0.674  0.00  0.00    +0.295 HD
ENDBRANCH  13  15
ENDBRANCH   5  13
TORSDOF 3