REMARK  Name = BDB008967
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.724  -0.348   2.164  0.00  0.00    +0.095 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.193   0.704   1.154  0.00  0.00    +0.069 A 
ATOM      3  C   LIG    1       -1.481   0.338  -0.273  0.00  0.00    -0.016 A 
ATOM      4  C   LIG    1       -1.500  -1.092  -0.733  0.00  0.00    +0.037 C 
ATOM      5  C   LIG    1       -2.236  -1.293  -2.062  0.00  0.00    +0.005 C 
ATOM      6  C   LIG    1       -1.809  -0.242  -3.077  0.00  0.00    +0.005 C 
ATOM      7  C   LIG    1       -2.111   1.167  -2.563  0.00  0.00    +0.041 C 
ATOM      8  C   LIG    1       -1.794   1.349  -1.104  0.00  0.00    +0.023 A 
ATOM      9  C   LIG    1       -1.891   2.738  -0.588  0.00  0.00    +0.268 A 
ATOM     10  O   LIG    1       -2.131   3.687  -1.328  0.00  0.00    -0.266 OA
ATOM     11  N   LIG    1       -1.741   2.880   0.763  0.00  0.00    -0.243 N 
ATOM     12  H   LIG    1       -1.785   3.820   1.141  0.00  0.00    +0.192 HD
ATOM     13  N   LIG    1       -1.372   1.901   1.628  0.00  0.00    -0.175 NA
ENDBRANCH   1   2
BRANCH   1  15
ATOM     14  C   LIG    1        1.708  -0.776   1.409  0.00  0.00    +0.129 A 
ATOM     15  C   LIG    1        0.432  -1.232   1.760  0.00  0.00    -0.011 A 
ATOM     16  C   LIG    1        0.236  -2.624   1.731  0.00  0.00    +0.008 A 
ATOM     17  C   LIG    1        1.252  -3.478   1.313  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        2.456  -2.923   0.930  0.00  0.00    +0.111 A 
ATOM     19  N   LIG    1        2.709  -1.600   0.964  0.00  0.00    -0.250 NA
BRANCH  14  23
ATOM     20  C   LIG    1        3.931   2.238   0.923  0.00  0.00    +0.128 C 
ATOM     21  N   LIG    1        3.269   0.969   0.793  0.00  0.00    -0.313 N 
ATOM     22  H   LIG    1        3.775   0.165   0.429  0.00  0.00    +0.149 HD
ATOM     23  C   LIG    1        2.135   0.664   1.520  0.00  0.00    +0.262 C 
ATOM     24  O   LIG    1        1.550   1.471   2.229  0.00  0.00    -0.269 OA
ENDBRANCH  14  23
ENDBRANCH   1  15
TORSDOF 3