REMARK  Name = BDB028093
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.233   0.783  -2.047  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -1.477   1.117  -1.493  0.00  0.00    +0.018 A 
ATOM      3  C   LIG    1       -2.359   0.087  -1.226  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1       -3.705   0.152  -0.647  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1       -4.201  -1.139  -0.636  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1       -3.201  -2.112  -1.054  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1       -4.229   1.168  -0.236  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1       -2.060  -1.250  -1.474  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1       -0.836  -1.600  -2.013  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1        0.076  -0.576  -2.297  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1       -5.454  -1.562  -0.020  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1       -5.395  -1.357   1.494  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1       -4.573  -1.938   2.204  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1       -6.268  -0.449   2.036  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1       -6.194  -0.311   3.034  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1       -7.102   0.423   1.387  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       -7.761   1.244   2.022  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1       -7.154   0.348  -0.118  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1       -6.723  -1.004  -0.658  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1        0.789   1.855  -2.333  0.00  0.00    +0.141 C 
BRANCH  20  24
ATOM     21  N   LIG    1        3.599   1.550  -0.051  0.00  0.00    -0.269 N 
ATOM     22  H   LIG    1        3.233   2.292   0.525  0.00  0.00    +0.156 HD
ATOM     23  C   LIG    1        2.917   1.321  -1.226  0.00  0.00    +0.304 C 
ATOM     24  N   LIG    1        1.714   1.998  -1.230  0.00  0.00    -0.295 N 
ATOM     25  H   LIG    1        1.296   2.159  -0.327  0.00  0.00    +0.151 HD
ATOM     26  O   LIG    1        3.293   0.638  -2.170  0.00  0.00    -0.252 OA
BRANCH  21  29
ATOM     27  C   LIG    1        6.596   0.964   2.038  0.00  0.00    +0.122 A 
ATOM     28  C   LIG    1        5.386   1.470   1.549  0.00  0.00    +0.069 A 
ATOM     29  C   LIG    1        4.823   0.986   0.360  0.00  0.00    +0.038 A 
ATOM     30  C   LIG    1        5.487  -0.026  -0.333  0.00  0.00    +0.023 A 
ATOM     31  C   LIG    1        6.695  -0.535   0.150  0.00  0.00    +0.005 A 
ATOM     32  C   LIG    1        7.251  -0.042   1.332  0.00  0.00    +0.046 A 
BRANCH  27  34
ATOM     33  C   LIG    1        8.254   1.065   3.739  0.00  0.00    +0.277 C 
ATOM     34  O   LIG    1        7.022   1.537   3.205  0.00  0.00    -0.495 OA
ENDBRANCH  27  34
ENDBRANCH  21  29
ENDBRANCH  20  24
ENDBRANCH   1  20
TORSDOF 5