REMARK  Name = BDB032478
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.054  -0.631  -1.961  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1       -1.059  -1.530  -2.968  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1        0.070  -1.621  -3.702  0.00  0.00    +0.115 A 
ATOM      4  C   LIG    1        1.204  -0.856  -3.478  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1        1.186   0.075  -2.436  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1        0.029   0.179  -1.658  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1       -2.166  -0.484  -1.158  0.00  0.00    -0.476 OA
BRANCH   7   8
ATOM      8  C   LIG    1       -3.265  -1.311  -1.547  0.00  0.00    +0.237 C 
BRANCH   8  13
ATOM      9  C   LIG    1       -5.548   0.951   2.887  0.00  0.00    +0.104 C 
ATOM     10  N   LIG    1       -4.797   0.957   1.635  0.00  0.00    -0.305 NA
ATOM     11  C   LIG    1       -3.729  -0.051   1.622  0.00  0.00    +0.085 C 
ATOM     12  C   LIG    1       -4.103  -1.331   0.872  0.00  0.00    +0.025 C 
ATOM     13  C   LIG    1       -4.478  -1.065  -0.611  0.00  0.00    +0.004 C 
ATOM     14  C   LIG    1       -5.588  -2.055  -1.026  0.00  0.00    +0.014 C 
ATOM     15  C   LIG    1       -4.987   0.390  -0.779  0.00  0.00    +0.025 C 
ATOM     16  C   LIG    1       -5.702   0.882   0.481  0.00  0.00    +0.085 C 
ENDBRANCH   8  13
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   5  17
ATOM     17  C   LIG    1        2.392   0.926  -2.127  0.00  0.00    +0.137 C 
BRANCH  17  18
ATOM     18  N   LIG    1        3.037   0.412  -0.928  0.00  0.00    -0.339 N 
ATOM     19  H   LIG    1        3.076  -0.603  -0.933  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1        4.255   0.960  -0.476  0.00  0.00    +0.035 A 
ATOM     21  C   LIG    1        4.957   0.333   0.603  0.00  0.00    +0.008 A 
ATOM     22  C   LIG    1        6.173   0.889   1.073  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1        6.846   0.231   2.127  0.00  0.00    +0.124 A 
ATOM     24  N   LIG    1        6.409  -0.898   2.710  0.00  0.00    -0.240 NA
ATOM     25  C   LIG    1        5.244  -1.400   2.265  0.00  0.00    +0.113 A 
ATOM     26  C   LIG    1        6.659   2.072   0.479  0.00  0.00    +0.012 A 
ATOM     27  C   LIG    1        5.947   2.715  -0.525  0.00  0.00    +0.003 A 
ATOM     28  C   LIG    1        4.498  -0.833   1.247  0.00  0.00    +0.030 A 
ATOM     29  C   LIG    1        4.749   2.173  -0.982  0.00  0.00    +0.023 A 
BRANCH  23  30
ATOM     30  N   LIG    1        8.046   0.720   2.660  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1        8.289   0.085   3.416  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1        7.915   1.665   3.004  0.00  0.00    +0.144 HD
ENDBRANCH  23  30
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   5  17
TORSDOF 7