REMARK  Name = BDB057266
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.698  -1.888  -0.278  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -0.441  -1.142   0.074  0.00  0.00    +0.015 A 
ATOM      3  C   LIG    1       -1.572  -1.111  -0.756  0.00  0.00    +0.002 A 
ATOM      4  C   LIG    1       -1.541  -1.836  -1.955  0.00  0.00    +0.010 A 
ATOM      5  C   LIG    1       -0.413  -2.574  -2.319  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.703  -2.598  -1.486  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -2.767  -0.349  -0.413  0.00  0.00    +0.089 A 
ATOM      8  N   LIG    1       -3.844  -0.208  -1.287  0.00  0.00    -0.232 NA
ATOM      9  C   LIG    1       -4.701   0.522  -0.626  0.00  0.00    +0.110 A 
ATOM     10  C   LIG    1       -6.048   1.077  -0.855  0.00  0.00    +0.076 C 
ATOM     11  C   LIG    1       -6.466   1.473   0.585  0.00  0.00    +0.029 C 
ATOM     12  C   LIG    1       -5.156   1.649   1.377  0.00  0.00    +0.123 C 
ATOM     13  N   LIG    1       -4.230   0.853   0.603  0.00  0.00    -0.334 N 
ATOM     14  C   LIG    1       -3.011   0.316   0.783  0.00  0.00    +0.115 A 
ENDBRANCH   3   7
BRANCH   1  15
ATOM     15  C   LIG    1        1.918  -1.879   0.602  0.00  0.00    +0.139 C 
BRANCH  15  18
ATOM     16  O   LIG    1        4.479  -1.535   1.635  0.00  0.00    -0.270 OA
ATOM     17  C   LIG    1        4.100  -0.781   0.746  0.00  0.00    +0.246 C 
ATOM     18  N   LIG    1        2.863  -0.885   0.147  0.00  0.00    -0.307 N 
ATOM     19  H   LIG    1        2.492  -0.112  -0.389  0.00  0.00    +0.149 HD
BRANCH  17  20
ATOM     20  C   LIG    1        4.973   0.327   0.294  0.00  0.00    +0.055 A 
ATOM     21  C   LIG    1        4.877   0.888  -0.972  0.00  0.00    +0.123 A 
ATOM     22  N   LIG    1        5.661   1.905  -1.411  0.00  0.00    -0.263 NA
ATOM     23  C   LIG    1        6.597   2.365  -0.552  0.00  0.00    +0.111 A 
ATOM     24  C   LIG    1        6.786   1.858   0.724  0.00  0.00    +0.020 A 
ATOM     25  C   LIG    1        5.962   0.819   1.150  0.00  0.00    +0.016 A 
ENDBRANCH  17  20
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 4