REMARK  Name = BDB051709
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.312   2.695  -0.825  0.00  0.00    +0.173 C 
ATOM      2  N   LIG    1        0.873   1.410  -0.475  0.00  0.00    -0.264 N 
ATOM      3  C   LIG    1        0.205   0.283  -0.101  0.00  0.00    +0.091 A 
ATOM      4  C   LIG    1       -1.215   0.039   0.063  0.00  0.00    +0.097 A 
ATOM      5  C   LIG    1       -1.615  -1.278   0.242  0.00  0.00    -0.001 A 
ATOM      6  C   LIG    1       -0.636  -2.426   0.162  0.00  0.00    +0.043 C 
ATOM      7  C   LIG    1        0.820  -2.060   0.552  0.00  0.00    +0.044 C 
ATOM      8  C   LIG    1       -2.968  -1.443   0.398  0.00  0.00    +0.120 A 
ATOM      9  N   LIG    1       -3.839  -0.415   0.406  0.00  0.00    -0.223 NA
ATOM     10  C   LIG    1       -3.334   0.811   0.224  0.00  0.00    +0.213 A 
ATOM     11  N   LIG    1       -2.041   1.096   0.062  0.00  0.00    -0.213 NA
ATOM     12  C   LIG    1        1.170  -0.683   0.103  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1        2.409  -0.049  -0.160  0.00  0.00    +0.151 A 
ATOM     14  N   LIG    1        2.216   1.240  -0.522  0.00  0.00    -0.166 NA
ENDROOT
BRANCH  13  15
ATOM     15  C   LIG    1        3.756  -0.630  -0.067  0.00  0.00    +0.262 C 
ATOM     16  O   LIG    1        3.987  -1.786   0.274  0.00  0.00    -0.269 OA
ATOM     17  N   LIG    1        4.760   0.237  -0.395  0.00  0.00    -0.324 N 
ATOM     18  H   LIG    1        4.511   1.187  -0.645  0.00  0.00    +0.145 HD
ATOM     19  H   LIG    1        5.721  -0.059  -0.338  0.00  0.00    +0.145 HD
ENDBRANCH  13  15
BRANCH  10  20
ATOM     20  N   LIG    1       -4.221   1.868   0.250  0.00  0.00    -0.327 N 
ATOM     21  H   LIG    1       -3.750   2.707   0.556  0.00  0.00    +0.145 HD
ATOM     22  H   LIG    1       -5.054   1.594   0.752  0.00  0.00    +0.145 HD
ENDBRANCH  10  20
TORSDOF 2