REMARK  Name = BDB053167
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.344  -0.439  -0.158  0.00  0.00    +0.120 A 
ATOM      2  C   LIG    1       -0.813   0.511   0.717  0.00  0.00    +0.046 A 
ATOM      3  C   LIG    1        0.574   0.612   0.891  0.00  0.00    +0.016 A 
ATOM      4  C   LIG    1        1.438  -0.234   0.186  0.00  0.00    +0.037 A 
ATOM      5  C   LIG    1        0.904  -1.194  -0.678  0.00  0.00    +0.016 A 
ATOM      6  C   LIG    1       -0.480  -1.290  -0.850  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.916  -0.165   0.340  0.00  0.00    +0.242 C 
ATOM      8  O   LIG    1        3.639  -1.110   0.054  0.00  0.00    -0.270 OA
ATOM      9  N   LIG    1        3.450   1.016   0.778  0.00  0.00    -0.325 N 
ATOM     10  H   LIG    1        2.936   1.883   0.730  0.00  0.00    +0.145 HD
ATOM     11  H   LIG    1        4.460   1.075   0.742  0.00  0.00    +0.145 HD
ENDBRANCH   4   7
BRANCH   1  13
ATOM     12  C   LIG    1       -3.598   0.187   0.276  0.00  0.00    +0.277 C 
ATOM     13  O   LIG    1       -2.671  -0.639  -0.418  0.00  0.00    -0.495 OA
ENDBRANCH   1  13
TORSDOF 2