REMARK  Name = BDB001730
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.684   0.328   0.789  0.00  0.00    -0.047 A 
ATOM      2  C   LIG    1       -1.711   0.423   1.736  0.00  0.00    +0.004 A 
ATOM      3  C   LIG    1       -2.991   0.830   1.355  0.00  0.00    +0.004 A 
ATOM      4  C   LIG    1       -3.267   1.147   0.019  0.00  0.00    -0.045 A 
ATOM      5  C   LIG    1       -2.241   1.048  -0.929  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1       -0.962   0.640  -0.547  0.00  0.00    +0.004 A 
ENDROOT
BRANCH   1   7
ATOM      7  C   LIG    1        0.695  -0.131   1.196  0.00  0.00    +0.035 C 
BRANCH   7   8
ATOM      8  C   LIG    1        0.828  -1.654   1.092  0.00  0.00    +0.011 C 
BRANCH   8   9
ATOM      9  C   LIG    1        2.189  -2.163   1.569  0.00  0.00    +0.059 C 
BRANCH   9  12
ATOM     10  C   LIG    1        3.404  -3.502  -1.283  0.00  0.00    +0.088 C 
ATOM     11  C   LIG    1        3.777  -2.329  -0.476  0.00  0.00    +0.126 A 
ATOM     12  C   LIG    1        3.311  -1.752   0.686  0.00  0.00    +0.083 A 
ATOM     13  N   LIG    1        4.063  -0.636   0.977  0.00  0.00    -0.214 NA
ATOM     14  C   LIG    1        4.947  -0.572  -0.002  0.00  0.00    +0.228 A 
ATOM     15  O   LIG    1        4.827  -1.579  -0.925  0.00  0.00    -0.440 OA
BRANCH  14  16
ATOM     16  C   LIG    1        6.006   0.408  -0.226  0.00  0.00    +0.037 A 
ATOM     17  C   LIG    1        6.171   1.469   0.678  0.00  0.00    +0.013 A 
ATOM     18  C   LIG    1        7.174   2.423   0.489  0.00  0.00    +0.001 A 
ATOM     19  C   LIG    1        8.027   2.328  -0.608  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1        7.878   1.282  -1.516  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        6.874   0.328  -1.326  0.00  0.00    +0.013 A 
ENDBRANCH  14  16
ENDBRANCH   9  12
ENDBRANCH   8   9
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   4  22
ATOM     22  C   LIG    1       -4.659   1.566  -0.399  0.00  0.00    +0.075 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -5.621   0.381  -0.540  0.00  0.00    +0.240 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -7.008   0.786  -0.711  0.00  0.00    -0.169 N 
ATOM     25  N   LIG    1       -7.358   2.014  -1.161  0.00  0.00    -0.160 NA
ATOM     26  C   LIG    1       -8.691   1.950  -1.117  0.00  0.00    +0.156 A 
ATOM     27  C   LIG    1       -9.091   0.708  -0.611  0.00  0.00    +0.156 A 
ATOM     28  N   LIG    1       -8.017  -0.034  -0.329  0.00  0.00    -0.160 NA
ENDBRANCH  23  24
BRANCH  23  29
ATOM     29  C   LIG    1       -5.230  -0.478  -1.713  0.00  0.00    +0.332 C 
ATOM     30  O   LIG    1       -5.253  -0.175  -2.897  0.00  0.00    -0.249 OA
BRANCH  29  31
ATOM     31  O   LIG    1       -4.770  -1.697  -1.350  0.00  0.00    -0.479 OA
ATOM     32  H   LIG    1       -4.538  -2.133  -2.197  0.00  0.00    +0.295 HD
ENDBRANCH  29  31
ENDBRANCH  23  29
ENDBRANCH  22  23
ENDBRANCH   4  22
TORSDOF 10