REMARK  Name = BDB029369
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.049   0.137  -0.064  0.00  0.00    -0.015 A 
ATOM      2  C   LIG    1       -0.904  -0.289  -1.097  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1       -2.264  -0.277  -0.865  0.00  0.00    +0.038 A 
ATOM      4  N   LIG    1       -3.274  -0.655  -1.734  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1       -3.149  -0.997  -2.675  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1       -4.525  -0.506  -1.148  0.00  0.00    +0.222 C 
ATOM      7  C   LIG    1       -4.310   0.032   0.271  0.00  0.00    +0.133 C 
ATOM      8  O   LIG    1       -5.595  -0.762  -1.676  0.00  0.00    -0.275 OA
ATOM      9  C   LIG    1       -2.816   0.139   0.343  0.00  0.00    -0.017 A 
ATOM     10  C   LIG    1       -2.006   0.563   1.375  0.00  0.00    +0.006 A 
ATOM     11  C   LIG    1       -0.621   0.559   1.165  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  15
ATOM     12  C   LIG    1        4.151   0.199  -0.692  0.00  0.00    +0.116 A 
ATOM     13  N   LIG    1        3.348   0.804  -1.577  0.00  0.00    -0.240 NA
ATOM     14  C   LIG    1        2.013   0.768  -1.342  0.00  0.00    +0.121 A 
ATOM     15  C   LIG    1        1.409   0.145  -0.252  0.00  0.00    +0.000 A 
ATOM     16  C   LIG    1        2.277  -0.475   0.652  0.00  0.00    +0.013 A 
ATOM     17  C   LIG    1        3.655  -0.450   0.433  0.00  0.00    +0.044 A 
BRANCH  12  18
ATOM     18  N   LIG    1        5.527   0.234  -0.932  0.00  0.00    -0.343 N 
ATOM     19  H   LIG    1        5.885  -0.712  -1.012  0.00  0.00    +0.144 HD
ATOM     20  H   LIG    1        5.998   0.689  -0.156  0.00  0.00    +0.144 HD
ENDBRANCH  12  18
ENDBRANCH   1  15
TORSDOF 2