REMARK  Name = BDB051968
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.292   0.019  -0.329  0.00  0.00    +0.034 A 
ATOM      2  C   LIG    1        1.234  -0.889  -0.183  0.00  0.00    +0.034 A 
ATOM      3  C   LIG    1       -0.110  -0.443  -0.179  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1       -1.352  -1.121  -0.064  0.00  0.00    +0.008 A 
ATOM      5  C   LIG    1       -2.378  -0.170  -0.146  0.00  0.00    +0.057 A 
ATOM      6  N   LIG    1       -1.776   1.100  -0.258  0.00  0.00    -0.280 N 
ATOM      7  C   LIG    1       -2.396   2.379  -0.294  0.00  0.00    +0.229 C 
ATOM      8  O   LIG    1       -1.744   3.378  -0.588  0.00  0.00    -0.273 OA
ATOM      9  C   LIG    1       -3.846   2.466   0.049  0.00  0.00    +0.113 C 
ATOM     10  C   LIG    1       -3.724  -0.602  -0.125  0.00  0.00    +0.027 A 
ATOM     11  C   LIG    1       -4.016  -1.963   0.019  0.00  0.00    +0.002 A 
ATOM     12  C   LIG    1       -3.003  -2.900   0.132  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -1.673  -2.490   0.086  0.00  0.00    +0.010 A 
ATOM     14  C   LIG    1       -0.381   0.914  -0.323  0.00  0.00    +0.058 A 
ATOM     15  C   LIG    1        0.679   1.834  -0.466  0.00  0.00    +0.029 A 
ATOM     16  C   LIG    1        2.002   1.369  -0.469  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  19
ATOM     17  C   LIG    1        5.987  -0.745  -0.404  0.00  0.00    +0.109 C 
ATOM     18  C   LIG    1        4.792   0.175  -0.455  0.00  0.00    +0.214 C 
ATOM     19  N   LIG    1        3.599  -0.514  -0.322  0.00  0.00    -0.286 N 
ATOM     20  H   LIG    1        3.665  -1.517  -0.215  0.00  0.00    +0.155 HD
ATOM     21  O   LIG    1        4.937   1.380  -0.621  0.00  0.00    -0.276 OA
ENDBRANCH   1  19
TORSDOF 1