REMARK  Name = BDB058360
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.909  -0.056  -0.761  0.00  0.00    +0.131 A 
ATOM      2  C   LIG    1       -2.241  -0.259   0.473  0.00  0.00    +0.052 A 
ATOM      3  C   LIG    1       -3.049  -0.449   1.605  0.00  0.00    +0.052 A 
ATOM      4  N   LIG    1       -2.219  -0.556   2.697  0.00  0.00    -0.360 N 
ATOM      5  H   LIG    1       -2.536  -0.693   3.648  0.00  0.00    +0.165 HD
ATOM      6  C   LIG    1       -0.916  -0.461   2.307  0.00  0.00    +0.095 A 
ATOM      7  C   LIG    1       -4.450  -0.505   1.551  0.00  0.00    +0.041 A 
ATOM      8  C   LIG    1       -5.058  -0.361   0.304  0.00  0.00    +0.023 A 
ATOM      9 BR   LIG    1       -6.944  -0.450   0.179  0.00  0.00    -0.050 Br
ATOM     10  C   LIG    1       -0.888  -0.317   0.935  0.00  0.00    +0.047 A 
ATOM     11  C   LIG    1       -4.307  -0.141  -0.842  0.00  0.00    +0.061 A 
ENDROOT
BRANCH  10  12
ATOM     12  C   LIG    1        0.474  -0.260   0.184  0.00  0.00    +0.158 A 
ATOM     13  O   LIG    1        1.690  -0.239   0.825  0.00  0.00    -0.434 OA
ATOM     14  C   LIG    1        2.625  -0.189  -0.177  0.00  0.00    +0.244 A 
ATOM     15  N   LIG    1        2.101  -0.192  -1.386  0.00  0.00    -0.216 NA
ATOM     16  C   LIG    1        0.745  -0.251  -1.164  0.00  0.00    +0.161 A 
BRANCH  14  17
ATOM     17  C   LIG    1        4.028  -0.141   0.078  0.00  0.00    +0.102 A 
ATOM     18  N   LIG    1        4.541  -0.142   1.351  0.00  0.00    -0.357 N 
ATOM     19  H   LIG    1        3.983  -0.177   2.195  0.00  0.00    +0.165 HD
ATOM     20  C   LIG    1        5.911  -0.090   1.300  0.00  0.00    +0.083 A 
ATOM     21  C   LIG    1        6.282  -0.055  -0.026  0.00  0.00    +0.020 A 
ATOM     22  C   LIG    1        5.094  -0.088  -0.797  0.00  0.00    +0.032 A 
ENDBRANCH  14  17
ENDBRANCH  10  12
BRANCH   1  24
ATOM     23  C   LIG    1       -2.184   1.615  -2.158  0.00  0.00    +0.277 C 
ATOM     24  O   LIG    1       -2.226   0.204  -1.929  0.00  0.00    -0.494 OA
ENDBRANCH   1  24
TORSDOF 3