REMARK  Name = BDB035011
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.040   0.120   0.339  0.00  0.00    +0.117 A 
ATOM      2  N   LIG    1        4.103   0.849  -0.284  0.00  0.00    -0.231 NA
ATOM      3  C   LIG    1        2.822   0.473  -0.062  0.00  0.00    +0.092 A 
ATOM      4  C   LIG    1        2.472  -0.597   0.755  0.00  0.00    +0.066 A 
ATOM      5  N   LIG    1        1.103  -0.676   0.740  0.00  0.00    -0.342 N 
ATOM      6  H   LIG    1        0.532  -1.347   1.242  0.00  0.00    +0.167 HD
ATOM      7  C   LIG    1        0.577   0.310  -0.061  0.00  0.00    +0.105 A 
ATOM      8  C   LIG    1        3.440  -1.355   1.404  0.00  0.00    +0.031 A 
ATOM      9  C   LIG    1        1.628   1.040  -0.571  0.00  0.00    +0.071 A 
ATOM     10  C   LIG    1        4.759  -0.965   1.172  0.00  0.00    +0.045 A 
ENDROOT
BRANCH   7  11
ATOM     11  N   LIG    1       -0.778   0.476  -0.270  0.00  0.00    -0.268 N 
ATOM     12  H   LIG    1       -1.067   1.255  -0.849  0.00  0.00    +0.156 HD
ATOM     13  C   LIG    1       -1.726  -0.328   0.344  0.00  0.00    +0.249 C 
ATOM     14  O   LIG    1       -1.475  -1.224   1.147  0.00  0.00    -0.270 OA
BRANCH  13  15
ATOM     15  C   LIG    1       -3.143  -0.030  -0.001  0.00  0.00    +0.037 A 
ATOM     16  C   LIG    1       -4.125  -0.252   0.973  0.00  0.00    +0.013 A 
ATOM     17  C   LIG    1       -5.466   0.015   0.691  0.00  0.00    +0.001 A 
ATOM     18  C   LIG    1       -5.831   0.493  -0.567  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -4.860   0.697  -1.547  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1       -3.517   0.433  -1.269  0.00  0.00    +0.013 A 
ENDBRANCH  13  15
ENDBRANCH   7  11
BRANCH   1  21
ATOM     21  N   LIG    1        6.381   0.485   0.129  0.00  0.00    -0.343 N 
ATOM     22  H   LIG    1        6.808   0.715   1.020  0.00  0.00    +0.144 HD
ATOM     23  H   LIG    1        6.883  -0.300  -0.274  0.00  0.00    +0.144 HD
ENDBRANCH   1  21
TORSDOF 3