REMARK  Name = BDB002294
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.621  -1.823  -0.214  0.00  0.00    +0.189 C 
ENDROOT
BRANCH   1   2
ATOM      2  N   LIG    1        0.472  -0.905   0.123  0.00  0.00    -0.279 N 
ATOM      3  C   LIG    1        1.381  -0.395  -0.785  0.00  0.00    +0.248 C 
ATOM      4  O   LIG    1        1.407  -0.542  -1.992  0.00  0.00    -0.270 OA
ATOM      5  C   LIG    1        2.358   0.379  -0.010  0.00  0.00    +0.042 A 
ATOM      6  C   LIG    1        2.026   0.267   1.341  0.00  0.00    -0.018 A 
ATOM      7  C   LIG    1        2.791   0.905   2.301  0.00  0.00    +0.006 A 
ATOM      8  C   LIG    1        3.893   1.655   1.874  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1        4.216   1.758   0.508  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        3.441   1.111  -0.456  0.00  0.00    +0.013 A 
ATOM     11  C   LIG    1        0.819  -0.596   1.498  0.00  0.00    +0.144 C 
ENDBRANCH   1   2
BRANCH   1  13
ATOM     12  O   LIG    1        0.973  -3.688  -0.032  0.00  0.00    -0.249 OA
ATOM     13  C   LIG    1       -0.021  -3.193  -0.546  0.00  0.00    +0.326 C 
BRANCH  13  14
ATOM     14  O   LIG    1       -0.737  -3.923  -1.424  0.00  0.00    -0.479 OA
ATOM     15  H   LIG    1       -0.207  -4.741  -1.531  0.00  0.00    +0.295 HD
ENDBRANCH  13  14
ENDBRANCH   1  13
BRANCH   1  16
ATOM     16  C   LIG    1       -1.563  -1.287  -1.307  0.00  0.00    +0.069 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.259  -0.004  -0.903  0.00  0.00    -0.045 A 
ATOM     18  C   LIG    1       -3.377  -0.035  -0.058  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1       -4.000   1.151   0.331  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -3.513   2.377  -0.119  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -2.403   2.418  -0.960  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -1.779   1.233  -1.351  0.00  0.00    +0.004 A 
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 5