REMARK  Name = BDB001863
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.456   0.494   0.175  0.00  0.00    +0.090 A 
ATOM      2  C   LIG    1        2.891  -0.709  -0.645  0.00  0.00    +0.270 A 
ATOM      3  O   LIG    1        4.080  -0.978  -0.800  0.00  0.00    -0.266 OA
ATOM      4  N   LIG    1        1.886  -1.483  -1.171  0.00  0.00    -0.327 N 
ATOM      5  H   LIG    1        2.189  -2.276  -1.722  0.00  0.00    +0.168 HD
ATOM      6  C   LIG    1        0.550  -1.242  -0.979  0.00  0.00    +0.094 A 
ATOM      7  C   LIG    1        0.137  -0.200  -0.236  0.00  0.00    +0.000 A 
ATOM      8  C   LIG    1        1.137   0.680   0.349  0.00  0.00    +0.038 A 
ENDROOT
BRANCH   7   9
ATOM      9  C   LIG    1       -1.309   0.014  -0.066  0.00  0.00    -0.014 A 
ATOM     10  C   LIG    1       -2.063  -0.822   0.759  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1       -3.418  -0.569   0.889  0.00  0.00    +0.111 A 
ATOM     12  N   LIG    1       -4.055   0.443   0.263  0.00  0.00    -0.263 NA
ATOM     13  C   LIG    1       -3.304   1.241  -0.526  0.00  0.00    +0.111 A 
ATOM     14  C   LIG    1       -1.944   1.072  -0.720  0.00  0.00    +0.028 A 
ENDBRANCH   7   9
BRANCH   1  15
ATOM     15  N   LIG    1        3.450   1.302   0.702  0.00  0.00    -0.354 N 
ATOM     16  H   LIG    1        3.219   1.677   1.617  0.00  0.00    +0.142 HD
ATOM     17  H   LIG    1        4.348   0.812   0.690  0.00  0.00    +0.142 HD
ENDBRANCH   1  15
TORSDOF 2