REMARK  Name = BDB020193
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.301  -0.306  -0.246  0.00  0.00    -0.282 N 
ATOM      2  H   LIG    1       -0.041  -0.191  -1.221  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        0.633  -0.811   0.638  0.00  0.00    +0.229 C 
ATOM      4  O   LIG    1        0.465  -1.007   1.837  0.00  0.00    -0.275 OA
ENDROOT
BRANCH   3   5
ATOM      5  C   LIG    1        1.985  -1.046  -0.012  0.00  0.00    +0.162 C 
ATOM      6  C   LIG    1        2.781  -2.116   0.697  0.00  0.00    +0.231 C 
ATOM      7  O   LIG    1        2.648  -3.310   0.436  0.00  0.00    -0.275 OA
ATOM      8  N   LIG    1        3.680  -1.702   1.649  0.00  0.00    -0.256 N 
ATOM      9  H   LIG    1        4.201  -2.433   2.112  0.00  0.00    +0.157 HD
ATOM     10  C   LIG    1        4.056  -0.417   1.949  0.00  0.00    +0.219 C 
ATOM     11  O   LIG    1        4.961  -0.189   2.747  0.00  0.00    -0.275 OA
ATOM     12  C   LIG    1        3.280   0.686   1.272  0.00  0.00    +0.097 C 
ATOM     13  C   LIG    1        2.787   0.252  -0.103  0.00  0.00    +0.031 C 
ENDBRANCH   3   5
BRANCH   1  15
ATOM     14  C   LIG    1       -2.384   0.555  -1.086  0.00  0.00    +0.141 A 
ATOM     15  C   LIG    1       -1.640   0.069   0.011  0.00  0.00    +0.076 A 
ATOM     16  C   LIG    1       -2.242  -0.019   1.268  0.00  0.00    +0.027 A 
ATOM     17  C   LIG    1       -3.571   0.374   1.438  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1       -4.304   0.854   0.357  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1       -3.714   0.946  -0.905  0.00  0.00    +0.047 A 
BRANCH  14  21
ATOM     20  C   LIG    1       -2.433   1.051  -3.420  0.00  0.00    +0.277 C 
ATOM     21  O   LIG    1       -1.703   0.606  -2.283  0.00  0.00    -0.493 OA
ENDBRANCH  14  21
ENDBRANCH   1  15
TORSDOF 3