REMARK  Name = BDB000615
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.653  -0.451   0.366  0.00  0.00    -0.035 A 
ATOM      2  C   LIG    1       -0.489   0.322   0.202  0.00  0.00    +0.051 A 
ATOM      3  C   LIG    1       -0.707   1.772   0.325  0.00  0.00    +0.250 C 
ATOM      4  C   LIG    1       -2.212   1.991   0.015  0.00  0.00    +0.289 C 
ATOM      5  N   LIG    1       -2.716   0.735  -0.249  0.00  0.00    -0.278 N 
ATOM      6  H   LIG    1       -3.683   0.574  -0.487  0.00  0.00    +0.155 HD
ATOM      7  O   LIG    1       -2.801   3.049   0.010  0.00  0.00    -0.266 OA
ATOM      8  O   LIG    1        0.102   2.627   0.605  0.00  0.00    -0.282 OA
ATOM      9  C   LIG    1       -1.723  -0.233  -0.143  0.00  0.00    +0.045 A 
ATOM     10  C   LIG    1       -1.877  -1.589  -0.345  0.00  0.00    +0.024 A 
ATOM     11  C   LIG    1       -0.744  -2.392  -0.193  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1        0.503  -1.833   0.154  0.00  0.00    +0.004 A 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1        2.733   0.646  -0.504  0.00  0.00    +0.009 C 
ATOM     14  C   LIG    1        1.992   0.132   0.721  0.00  0.00    +0.032 C 
ENDBRANCH   1  14
TORSDOF 1