REMARK  Name = BDB032730
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.882  -1.478   1.133  0.00  0.00    -0.010 A 
ATOM      2  C   LIG    1        1.833  -1.310   0.117  0.00  0.00    +0.020 A 
ATOM      3  C   LIG    1        3.067  -0.796   0.470  0.00  0.00    +0.042 A 
ATOM      4  C   LIG    1        4.233  -0.528  -0.379  0.00  0.00    +0.248 C 
ATOM      5  N   LIG    1        5.195   0.058   0.432  0.00  0.00    -0.282 N 
ATOM      6  C   LIG    1        4.799   0.051   1.834  0.00  0.00    +0.144 C 
ATOM      7  O   LIG    1        4.304  -0.799  -1.562  0.00  0.00    -0.270 OA
ATOM      8  C   LIG    1        3.393  -0.442   1.777  0.00  0.00    -0.018 A 
ATOM      9  C   LIG    1        2.465  -0.593   2.791  0.00  0.00    +0.006 A 
ATOM     10  C   LIG    1        1.204  -1.106   2.461  0.00  0.00    +0.007 A 
ENDROOT
BRANCH   5  11
ATOM     11  C   LIG    1        6.584   0.270   0.038  0.00  0.00    +0.163 C 
ATOM     12  C   LIG    1        7.369  -1.052   0.030  0.00  0.00    +0.240 C 
ATOM     13  O   LIG    1        7.126  -1.990   0.789  0.00  0.00    -0.273 OA
ATOM     14  N   LIG    1        8.463  -1.098  -0.803  0.00  0.00    -0.255 N 
ATOM     15  H   LIG    1        8.999  -1.954  -0.779  0.00  0.00    +0.158 HD
ATOM     16  C   LIG    1        8.985  -0.083  -1.564  0.00  0.00    +0.219 C 
ATOM     17  O   LIG    1       10.060  -0.215  -2.143  0.00  0.00    -0.275 OA
ATOM     18  C   LIG    1        8.222   1.221  -1.572  0.00  0.00    +0.098 C 
ATOM     19  C   LIG    1        6.744   0.997  -1.297  0.00  0.00    +0.041 C 
ENDBRANCH   5  11
BRANCH   1  20
ATOM     20  C   LIG    1       -0.490  -2.011   0.807  0.00  0.00    +0.269 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.323  -0.895   0.486  0.00  0.00    -0.445 OA
BRANCH  21  24
ATOM     22  N   LIG    1       -3.303  -0.090  -0.051  0.00  0.00    -0.250 N 
ATOM     23  H   LIG    1       -2.738   0.747  -0.020  0.00  0.00    +0.158 HD
ATOM     24  C   LIG    1       -2.614  -1.233   0.234  0.00  0.00    +0.405 C 
ATOM     25  O   LIG    1       -3.043  -2.375   0.272  0.00  0.00    -0.226 OA
BRANCH  22  30
ATOM     26  C   LIG    1       -7.349   0.377  -0.976  0.00  0.00    +0.044 A 
ATOM     27  C   LIG    1       -6.528   1.508  -0.902  0.00  0.00    -0.027 A 
ATOM     28  C   LIG    1       -7.041   2.895  -1.157  0.00  0.00    +0.045 C 
ATOM     29  C   LIG    1       -5.171   1.314  -0.596  0.00  0.00    +0.030 A 
ATOM     30  C   LIG    1       -4.668   0.034  -0.360  0.00  0.00    +0.055 A 
ATOM     31  C   LIG    1       -5.564  -1.021  -0.449  0.00  0.00    +0.134 A 
ATOM     32  N   LIG    1       -6.879  -0.875  -0.747  0.00  0.00    -0.258 NA
BRANCH  26  34
ATOM     33  C   LIG    1       -9.658   0.572  -0.018  0.00  0.00    +0.010 C 
ATOM     34  C   LIG    1       -8.823   0.461  -1.285  0.00  0.00    +0.052 C 
ENDBRANCH  26  34
ENDBRANCH  22  30
ENDBRANCH  21  24
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 6