REMARK  Name = BDB063142
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        2.168   0.642  -0.623  0.00  0.00    -0.282 N 
ATOM      2  H   LIG    1        2.762   1.417  -0.883  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        2.936  -0.340  -0.009  0.00  0.00    +0.220 A 
ATOM      4  N   LIG    1        4.244  -0.051   0.104  0.00  0.00    -0.211 NA
ATOM      5  C   LIG    1        5.066  -0.963   0.688  0.00  0.00    +0.111 A 
ATOM      6  C   LIG    1        4.574  -2.161   1.167  0.00  0.00    +0.167 A 
ATOM      7  F   LIG    1        5.339  -3.080   1.771  0.00  0.00    -0.202 F 
ATOM      8  C   LIG    1        3.228  -2.372   1.014  0.00  0.00    +0.155 A 
ATOM      9  N   LIG    1        2.397  -1.485   0.431  0.00  0.00    -0.220 NA
BRANCH   5  10
ATOM     10  C   LIG    1        6.489  -0.567   0.767  0.00  0.00    +0.005 A 
ATOM     11  C   LIG    1        6.839   0.790   0.927  0.00  0.00    +0.039 A 
ATOM     12  C   LIG    1        8.187   1.200   1.002  0.00  0.00    +0.079 A 
ATOM     13  C   LIG    1        9.187   0.231   0.910  0.00  0.00    +0.039 A 
ATOM     14  S   LIG    1       10.726   0.997   1.030  0.00  0.00    -0.075 S 
ATOM     15  C   LIG    1        9.947   2.513   1.192  0.00  0.00    +0.157 A 
ATOM     16  C   LIG    1        8.883  -1.127   0.743  0.00  0.00    +0.018 A 
ATOM     17  N   LIG    1        8.634   2.502   1.164  0.00  0.00    -0.247 NA
ATOM     18  C   LIG    1        7.533  -1.501   0.672  0.00  0.00    +0.011 A 
ENDBRANCH   5  10
ENDBRANCH   1   3
BRANCH   1  22
ATOM     19  C   LIG    1       -1.889   0.998  -1.571  0.00  0.00    +0.126 A 
ATOM     20  N   LIG    1       -1.471  -0.136  -0.962  0.00  0.00    -0.249 NA
ATOM     21  C   LIG    1       -0.148  -0.232  -0.660  0.00  0.00    +0.134 A 
ATOM     22  C   LIG    1        0.811   0.741  -0.934  0.00  0.00    +0.052 A 
ATOM     23  C   LIG    1        0.341   1.893  -1.571  0.00  0.00    +0.027 A 
ATOM     24  C   LIG    1       -1.011   2.027  -1.896  0.00  0.00    +0.035 A 
BRANCH  19  29
ATOM     25  N   LIG    1       -6.414  -0.358   0.502  0.00  0.00    -0.300 NA
ATOM     26  C   LIG    1       -5.419  -1.367   0.111  0.00  0.00    +0.103 C 
ATOM     27  C   LIG    1       -4.114  -0.713  -0.392  0.00  0.00    +0.123 C 
ATOM     28  N   LIG    1       -4.334   0.336  -1.393  0.00  0.00    -0.294 N 
ATOM     29  C   LIG    1       -3.341   1.148  -1.949  0.00  0.00    +0.265 C 
ATOM     30  O   LIG    1       -3.621   2.032  -2.765  0.00  0.00    -0.268 OA
ATOM     31  C   LIG    1       -5.721   0.526  -1.804  0.00  0.00    +0.123 C 
ATOM     32  C   LIG    1       -6.695   0.584  -0.605  0.00  0.00    +0.103 C 
BRANCH  25  34
ATOM     33  C   LIG    1       -8.526   0.054   1.742  0.00  0.00    +0.020 C 
ATOM     34  C   LIG    1       -7.622  -0.969   1.063  0.00  0.00    +0.081 C 
ENDBRANCH  25  34
ENDBRANCH  19  29
ENDBRANCH   1  22
TORSDOF 5