REMARK  Name = BDB051678
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.319  -0.928  -0.284  0.00  0.00    +0.029 A 
ATOM      2  C   LIG    1        0.143  -0.318   0.192  0.00  0.00    -0.013 A 
ATOM      3  C   LIG    1       -0.873  -1.067   1.024  0.00  0.00    +0.056 C 
ATOM      4  C   LIG    1       -2.263  -0.462   0.863  0.00  0.00    +0.109 C 
ATOM      5  N   LIG    1       -2.244   0.966   1.055  0.00  0.00    -0.311 N 
ATOM      6  H   LIG    1       -3.102   1.460   1.268  0.00  0.00    +0.149 HD
ATOM      7  C   LIG    1       -1.284   1.751   0.464  0.00  0.00    +0.244 C 
ATOM      8  O   LIG    1       -1.435   2.963   0.369  0.00  0.00    -0.270 OA
ATOM      9  C   LIG    1       -0.065   1.060  -0.048  0.00  0.00    +0.042 A 
ATOM     10  C   LIG    1        0.883   1.818  -0.743  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        2.058   1.220  -1.180  0.00  0.00    +0.003 A 
ATOM     12  C   LIG    1        2.280  -0.134  -0.929  0.00  0.00    +0.023 A 
ENDROOT
BRANCH   1  13
ATOM     13  N   LIG    1        1.667  -2.244   0.056  0.00  0.00    -0.358 N 
ATOM     14  H   LIG    1        2.379  -2.648  -0.546  0.00  0.00    +0.142 HD
ATOM     15  H   LIG    1        0.888  -2.877   0.191  0.00  0.00    +0.142 HD
ENDBRANCH   1  13
TORSDOF 1