REMARK  Name = BDB005567
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -5.257   1.642   2.847  0.00  0.00    -0.268 OA
ATOM      2  C   LIG    1       -4.401   1.232   2.068  0.00  0.00    +0.254 A 
ATOM      3  C   LIG    1       -4.755   0.584   0.777  0.00  0.00    +0.038 A 
ATOM      4  C   LIG    1       -6.223   0.445   0.470  0.00  0.00    +0.044 C 
ATOM      5  C   LIG    1       -6.487   0.084  -0.996  0.00  0.00    +0.023 C 
ATOM      6  C   LIG    1       -5.516  -0.989  -1.472  0.00  0.00    +0.102 C 
ATOM      7  N   LIG    1       -4.147  -0.542  -1.238  0.00  0.00    -0.343 N 
ATOM      8  H   LIG    1       -3.451  -1.222  -1.533  0.00  0.00    +0.146 HD
ATOM      9  C   LIG    1       -3.806   0.123  -0.063  0.00  0.00    +0.045 A 
ATOM     10  C   LIG    1       -2.376   0.320   0.278  0.00  0.00    +0.023 A 
ATOM     11  C   LIG    1       -2.053   0.914   1.505  0.00  0.00    +0.051 A 
ATOM     12  C   LIG    1       -0.724   1.107   1.888  0.00  0.00    +0.030 A 
ATOM     13  C   LIG    1        0.311   0.721   1.033  0.00  0.00    +0.048 A 
ATOM     14  C   LIG    1        0.018   0.157  -0.206  0.00  0.00    +0.121 A 
ATOM     15  C   LIG    1       -1.320  -0.039  -0.574  0.00  0.00    +0.057 A 
ATOM     16  N   LIG    1       -3.071   1.338   2.362  0.00  0.00    -0.322 N 
ATOM     17  H   LIG    1       -2.853   1.780   3.244  0.00  0.00    +0.169 HD
ENDROOT
BRANCH  14  18
ATOM     18  O   LIG    1        0.924  -0.258  -1.141  0.00  0.00    -0.491 OA
BRANCH  18  19
ATOM     19  C   LIG    1        2.308   0.056  -0.952  0.00  0.00    +0.244 C 
BRANCH  19  20
ATOM     20  C   LIG    1        3.017  -1.067  -0.172  0.00  0.00    +0.125 C 
BRANCH  20  21
ATOM     21  N   LIG    1        4.457  -0.918   0.071  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1        5.279  -1.066  -1.141  0.00  0.00    +0.112 C 
ATOM     23  C   LIG    1        6.714  -0.576  -0.896  0.00  0.00    +0.175 C 
ATOM     24  O   LIG    1        6.779   0.825  -0.593  0.00  0.00    -0.377 OA
ATOM     25  C   LIG    1        5.590   1.329   0.029  0.00  0.00    +0.175 C 
ATOM     26  C   LIG    1        4.835   0.272   0.852  0.00  0.00    +0.112 C 
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH  14  18
TORSDOF 4