REMARK  Name = BDB012293
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.959   1.440  -0.755  0.00  0.00    -0.214 N 
ATOM      2  C   LIG    1       -0.382   1.719  -1.032  0.00  0.00    +0.076 A 
ATOM      3  C   LIG    1       -0.408   3.007  -1.533  0.00  0.00    +0.050 A 
ATOM      4  C   LIG    1        0.920   3.443  -1.510  0.00  0.00    +0.135 A 
ATOM      5  N   LIG    1        1.753   2.519  -1.039  0.00  0.00    -0.173 NA
ENDROOT
BRANCH   2   6
ATOM      6  C   LIG    1       -1.512   0.817  -0.835  0.00  0.00    +0.003 A 
ATOM      7  C   LIG    1       -2.065   0.661   0.447  0.00  0.00    +0.037 A 
ATOM      8  C   LIG    1       -3.158  -0.202   0.574  0.00  0.00    +0.066 A 
ATOM      9  C   LIG    1       -3.712  -0.886  -0.501  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1       -4.773  -1.629   0.062  0.00  0.00    +0.142 A 
ATOM     11  N   LIG    1       -4.892  -1.443   1.380  0.00  0.00    -0.181 NA
ATOM     12  C   LIG    1       -3.162  -0.714  -1.782  0.00  0.00    +0.012 A 
ATOM     13  N   LIG    1       -3.901  -0.578   1.662  0.00  0.00    -0.277 N 
ATOM     14  H   LIG    1       -3.782  -0.280   2.623  0.00  0.00    +0.189 HD
ATOM     15  C   LIG    1       -2.063   0.144  -1.933  0.00  0.00    +0.011 A 
ENDBRANCH   2   6
BRANCH   1  18
ATOM     16  C   LIG    1        3.478  -1.007   0.439  0.00  0.00    +0.064 A 
ATOM     17  C   LIG    1        2.918   0.177  -0.047  0.00  0.00    +0.063 A 
ATOM     18  C   LIG    1        1.542   0.227  -0.250  0.00  0.00    +0.155 A 
ATOM     19  N   LIG    1        0.739  -0.838   0.011  0.00  0.00    -0.236 NA
ATOM     20  C   LIG    1        1.306  -1.969   0.477  0.00  0.00    +0.114 A 
ATOM     21  C   LIG    1        2.659  -2.103   0.707  0.00  0.00    +0.035 A 
BRANCH  16  23
ATOM     22  O   LIG    1        5.483  -2.147   1.106  0.00  0.00    -0.245 OA
ATOM     23  C   LIG    1        4.931  -1.148   0.685  0.00  0.00    +0.337 C 
BRANCH  23  24
ATOM     24  O   LIG    1        5.621  -0.034   0.393  0.00  0.00    -0.477 OA
ATOM     25  H   LIG    1        6.552  -0.264   0.598  0.00  0.00    +0.295 HD
ENDBRANCH  23  24
ENDBRANCH  16  23
ENDBRANCH   1  18
TORSDOF 4