REMARK  Name = BDB048359
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.688   2.419  -0.747  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1        4.173   0.991  -0.796  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1        3.234  -0.007  -0.561  0.00  0.00    -0.297 N 
ATOM      4  C   LIG    1        1.780   0.266  -0.562  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1        1.030  -0.855   0.060  0.00  0.00    +0.032 A 
ATOM      6  C   LIG    1        1.617  -2.041   0.436  0.00  0.00    +0.044 A 
ATOM      7  N   LIG    1        0.635  -2.811   0.962  0.00  0.00    -0.279 N 
ATOM      8  H   LIG    1        0.696  -3.745   1.355  0.00  0.00    +0.189 HD
ATOM      9  N   LIG    1       -0.563  -2.210   0.936  0.00  0.00    -0.158 NA
ATOM     10  C   LIG    1        3.051  -2.370   0.300  0.00  0.00    +0.074 C 
ATOM     11  C   LIG    1       -0.347  -1.008   0.387  0.00  0.00    +0.150 A 
ATOM     12  C   LIG    1        3.667  -1.411  -0.741  0.00  0.00    +0.114 C 
ATOM     13  O   LIG    1        5.359   0.753  -1.025  0.00  0.00    -0.276 OA
ENDROOT
BRANCH  11  14
ATOM     14  N   LIG    1       -1.251  -0.021   0.160  0.00  0.00    -0.298 N 
ATOM     15  H   LIG    1       -0.901   0.840  -0.233  0.00  0.00    +0.154 HD
BRANCH  14  16
ATOM     16  C   LIG    1       -2.662   0.021   0.303  0.00  0.00    +0.035 A 
ATOM     17  C   LIG    1       -3.347   1.259   0.211  0.00  0.00    -0.029 A 
ATOM     18  C   LIG    1       -2.625   2.554  -0.054  0.00  0.00    +0.045 C 
ATOM     19  C   LIG    1       -4.745   1.303   0.369  0.00  0.00    +0.005 A 
ATOM     20  C   LIG    1       -5.471   0.145   0.633  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -4.808  -1.069   0.743  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1       -3.420  -1.126   0.584  0.00  0.00    +0.023 A 
ENDBRANCH  14  16
ENDBRANCH  11  14
TORSDOF 2