REMARK  Name = BDB025415
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        5.011   0.149  -1.457  0.00  0.00    +0.105 C 
ATOM      2  N   LIG    1        4.657  -1.062  -0.717  0.00  0.00    -0.301 NA
ATOM      3  C   LIG    1        3.249  -1.457  -0.946  0.00  0.00    +0.124 C 
ATOM      4  C   LIG    1        2.308  -0.666  -0.101  0.00  0.00    +0.029 A 
ATOM      5  C   LIG    1        2.711   0.026   1.051  0.00  0.00    +0.071 A 
ATOM      6  N   LIG    1        1.706   0.626   1.677  0.00  0.00    -0.167 NA
ATOM      7  N   LIG    1        0.605   0.391   0.888  0.00  0.00    -0.185 N 
ATOM      8  C   LIG    1       -0.596   1.060   1.241  0.00  0.00    +0.257 C 
ATOM      9  O   LIG    1       -0.674   1.643   2.321  0.00  0.00    -0.270 OA
ATOM     10  C   LIG    1        4.123   0.093   1.506  0.00  0.00    +0.073 C 
ATOM     11  C   LIG    1        0.941  -0.493  -0.164  0.00  0.00    +0.127 A 
ATOM     12  C   LIG    1        4.967  -0.942   0.728  0.00  0.00    +0.090 C 
ENDROOT
BRANCH   8  13
ATOM     13  C   LIG    1       -1.714   1.037   0.223  0.00  0.00    +0.113 C 
ATOM     14  C   LIG    1       -2.832   0.049   0.535  0.00  0.00    -0.014 A 
ATOM     15  C   LIG    1       -4.139   0.333   0.087  0.00  0.00    +0.031 A 
ATOM     16  C   LIG    1       -5.164  -0.586   0.353  0.00  0.00    +0.023 A 
ATOM     17  C   LIG    1       -4.904  -1.790   1.005  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1       -3.613  -2.081   1.429  0.00  0.00    +0.000 A 
ATOM     19  N   LIG    1       -4.482   1.567  -0.472  0.00  0.00    -0.344 N 
ATOM     20  H   LIG    1       -5.282   1.525  -1.096  0.00  0.00    +0.146 HD
ATOM     21  C   LIG    1       -3.417   2.454  -0.905  0.00  0.00    +0.102 C 
ATOM     22  C   LIG    1       -2.584  -1.168   1.199  0.00  0.00    +0.006 A 
ATOM     23  C   LIG    1       -2.291   2.460   0.114  0.00  0.00    +0.036 C 
ENDBRANCH   8  13
BRANCH  11  24
ATOM     24  N   LIG    1        0.084  -1.067  -1.050  0.00  0.00    -0.343 N 
ATOM     25  H   LIG    1        0.440  -1.801  -1.662  0.00  0.00    +0.144 HD
ATOM     26  H   LIG    1       -0.881  -1.278  -0.798  0.00  0.00    +0.144 HD
ENDBRANCH  11  24
TORSDOF 2