REMARK  Name = BDB028573
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.278  -0.662  -0.233  0.00  0.00    -0.448 OA
ENDROOT
BRANCH   1   3
ATOM      2  O   LIG    1       -0.422  -2.199   1.454  0.00  0.00    -0.226 OA
ATOM      3  C   LIG    1       -0.907  -1.287   0.798  0.00  0.00    +0.403 C 
ATOM      4  N   LIG    1       -2.142  -0.763   1.010  0.00  0.00    -0.266 N 
ATOM      5  C   LIG    1       -3.225  -1.240   1.845  0.00  0.00    +0.125 C 
ATOM      6  C   LIG    1       -4.175  -0.709   0.748  0.00  0.00    +0.110 C 
ATOM      7  C   LIG    1       -2.979   0.105   0.213  0.00  0.00    +0.125 C 
BRANCH   6   8
ATOM      8  C   LIG    1       -5.417   0.090   1.206  0.00  0.00    +0.222 C 
ATOM      9  N   LIG    1       -6.430   0.288   0.270  0.00  0.00    -0.297 N 
ATOM     10  C   LIG    1       -6.373  -0.136  -1.131  0.00  0.00    +0.136 C 
ATOM     11  C   LIG    1       -7.342   0.676  -1.997  0.00  0.00    +0.179 C 
ATOM     12  O   LIG    1       -8.704   0.590  -1.560  0.00  0.00    -0.377 OA
ATOM     13  C   LIG    1       -8.859   0.441  -0.141  0.00  0.00    +0.179 C 
ATOM     14  C   LIG    1       -7.669   0.958   0.674  0.00  0.00    +0.136 C 
ATOM     15  O   LIG    1       -5.532   0.535   2.354  0.00  0.00    -0.275 OA
ENDBRANCH   6   8
ENDBRANCH   1   3
BRANCH   1  16
ATOM     16  C   LIG    1        1.048  -1.146  -0.533  0.00  0.00    +0.266 C 
BRANCH  16  17
ATOM     17  C   LIG    1        2.077  -0.452   0.371  0.00  0.00    +0.166 C 
BRANCH  17  18
ATOM     18  O   LIG    1        2.007   0.958   0.101  0.00  0.00    -0.387 OA
ATOM     19  H   LIG    1        1.081   1.216   0.255  0.00  0.00    +0.210 HD
ENDBRANCH  17  18
BRANCH  17  20
ATOM     20  C   LIG    1        3.497  -0.996   0.083  0.00  0.00    +0.119 C 
BRANCH  20  21
ATOM     21  N   LIG    1        4.484  -0.707   1.147  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1        4.919   0.703   1.173  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1        5.893   1.091   0.078  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1        6.698   0.123  -0.550  0.00  0.00    -0.042 A 
ATOM     25  C   LIG    1        7.622   0.514  -1.528  0.00  0.00    +0.004 A 
ATOM     26  C   LIG    1        7.763   1.859  -1.866  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        6.979   2.822  -1.236  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        6.517  -1.338  -0.224  0.00  0.00    +0.051 C 
ATOM     29  C   LIG    1        6.051   2.442  -0.266  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1        5.677  -1.566   1.043  0.00  0.00    +0.089 C 
ENDBRANCH  20  21
ENDBRANCH  17  20
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7