REMARK  Name = BDB064527
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.309   0.040  -0.139  0.00  0.00    +0.038 A 
ATOM      2  C   LIG    1       -0.542   0.975  -0.901  0.00  0.00    +0.004 A 
ATOM      3  C   LIG    1        0.761   0.631  -1.346  0.00  0.00    -0.004 A 
ATOM      4  C   LIG    1        1.492   1.569  -2.117  0.00  0.00    +0.009 A 
ATOM      5  C   LIG    1        0.971   2.824  -2.425  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1       -0.292   3.173  -1.971  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1        1.272  -0.636  -0.985  0.00  0.00    +0.049 A 
ATOM      8  C   LIG    1        0.519  -1.560  -0.259  0.00  0.00    +0.016 A 
ATOM      9  C   LIG    1       -1.034   2.260  -1.223  0.00  0.00    +0.010 A 
ATOM     10  C   LIG    1       -0.764  -1.220   0.155  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   7  11
ATOM     11  C   LIG    1        2.643  -1.030  -1.346  0.00  0.00    +0.282 C 
ATOM     12  N   LIG    1        3.771  -0.719  -0.563  0.00  0.00    -0.162 N 
ATOM     13  C   LIG    1        3.873  -0.058   0.660  0.00  0.00    +0.219 A 
ATOM     14  N   LIG    1        5.122  -0.049   1.049  0.00  0.00    -0.192 NA
ATOM     15  C   LIG    1        5.803  -0.689   0.034  0.00  0.00    +0.202 A 
ATOM     16  N   LIG    1        5.012  -1.095  -0.970  0.00  0.00    -0.139 NA
ATOM     17  O   LIG    1        2.781  -1.664  -2.392  0.00  0.00    -0.265 OA
BRANCH  15  18
ATOM     18  C   LIG    1        7.261  -0.882   0.081  0.00  0.00    +0.110 A 
ATOM     19  N   LIG    1        7.855  -1.480  -0.985  0.00  0.00    -0.252 NA
ATOM     20  C   LIG    1        9.193  -1.657  -0.937  0.00  0.00    +0.111 A 
ATOM     21  C   LIG    1        9.984  -1.263   0.128  0.00  0.00    +0.020 A 
ATOM     22  C   LIG    1        9.368  -0.651   1.212  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        7.989  -0.457   1.192  0.00  0.00    +0.031 A 
ENDBRANCH  15  18
BRANCH  13  24
ATOM     24  N   LIG    1        2.859   0.483   1.372  0.00  0.00    -0.327 N 
ATOM     25  H   LIG    1        3.169   1.033   2.171  0.00  0.00    +0.145 HD
ATOM     26  H   LIG    1        2.095   0.958   0.899  0.00  0.00    +0.145 HD
ENDBRANCH  13  24
ENDBRANCH   7  11
BRANCH   1  30
ATOM     27  N   LIG    1       -5.356  -0.526   1.094  0.00  0.00    -0.297 NA
ATOM     28  C   LIG    1       -4.492   0.386   1.873  0.00  0.00    +0.103 C 
ATOM     29  C   LIG    1       -2.987   0.104   1.666  0.00  0.00    +0.120 C 
ATOM     30  N   LIG    1       -2.618   0.370   0.262  0.00  0.00    -0.327 N 
ATOM     31  C   LIG    1       -3.649   0.010  -0.741  0.00  0.00    +0.120 C 
ATOM     32  C   LIG    1       -4.717  -0.953  -0.168  0.00  0.00    +0.103 C 
BRANCH  27  34
ATOM     33  C   LIG    1       -6.975   1.062  -0.043  0.00  0.00    +0.024 C 
ATOM     34  C   LIG    1       -6.743  -0.043   0.994  0.00  0.00    +0.051 C 
ATOM     35  C   LIG    1       -7.693  -1.219   0.737  0.00  0.00    +0.024 C 
ENDBRANCH  27  34
ENDBRANCH   1  30
TORSDOF 5