REMARK  Name = BDB036938
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.775  -0.523   0.405  0.00  0.00    +0.144 C 
ATOM      2  C   LIG    1       -0.968   1.000   0.555  0.00  0.00    +0.236 C 
ATOM      3  O   LIG    1       -0.182   1.758   1.121  0.00  0.00    -0.274 OA
ATOM      4  N   LIG    1       -2.154   1.513   0.077  0.00  0.00    -0.255 N 
ATOM      5  H   LIG    1       -2.285   2.506   0.212  0.00  0.00    +0.158 HD
ATOM      6  C   LIG    1       -3.247   0.827  -0.386  0.00  0.00    +0.219 C 
ATOM      7  O   LIG    1       -4.306   1.404  -0.617  0.00  0.00    -0.275 OA
ATOM      8  C   LIG    1       -3.098  -0.666  -0.512  0.00  0.00    +0.098 C 
ATOM      9  C   LIG    1       -1.647  -1.051  -0.742  0.00  0.00    +0.037 C 
ENDROOT
BRANCH   1  13
ATOM     10  C   LIG    1        3.522   0.764   0.496  0.00  0.00    +0.010 C 
ATOM     11  C   LIG    1        2.613  -0.414   0.215  0.00  0.00    +0.014 C 
ATOM     12  C   LIG    1        1.531  -0.734   1.278  0.00  0.00    +0.089 C 
ATOM     13  N   LIG    1        0.600  -1.004   0.164  0.00  0.00    -0.291 NA
ATOM     14  C   LIG    1        1.417  -0.167  -0.738  0.00  0.00    +0.089 C 
ENDBRANCH   1  13
TORSDOF 1