REMARK  Name = BDB028562
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.048  -1.151   1.355  0.00  0.00    +0.166 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1       -0.635  -2.192   2.082  0.00  0.00    -0.387 OA
ATOM      3  H   LIG    1       -1.584  -2.071   1.893  0.00  0.00    +0.210 HD
ENDBRANCH   1   2
BRANCH   1   4
ATOM      4  C   LIG    1       -0.576   0.189   1.768  0.00  0.00    +0.266 C 
BRANCH   4   5
ATOM      5  O   LIG    1       -1.965   0.217   1.376  0.00  0.00    -0.448 OA
BRANCH   5   7
ATOM      6  O   LIG    1       -1.320   0.964  -0.675  0.00  0.00    -0.226 OA
ATOM      7  C   LIG    1       -2.208   0.646   0.106  0.00  0.00    +0.403 C 
ATOM      8  N   LIG    1       -3.561   0.661  -0.202  0.00  0.00    -0.265 N 
ATOM      9  C   LIG    1       -3.930   0.904  -1.598  0.00  0.00    +0.142 C 
ATOM     10  C   LIG    1       -5.343   1.479  -1.770  0.00  0.00    +0.132 C 
ATOM     11  C   LIG    1       -6.368   0.695  -0.953  0.00  0.00    +0.034 C 
ATOM     12  C   LIG    1       -5.939   0.604   0.509  0.00  0.00    +0.022 C 
ATOM     13  C   LIG    1       -4.547  -0.004   0.644  0.00  0.00    +0.111 C 
BRANCH  10  14
ATOM     14  O   LIG    1       -5.355   2.850  -1.365  0.00  0.00    -0.390 OA
ATOM     15  H   LIG    1       -6.254   3.193  -1.504  0.00  0.00    +0.210 HD
ENDBRANCH  10  14
ENDBRANCH   5   7
ENDBRANCH   4   5
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1        1.558  -1.229   1.681  0.00  0.00    +0.119 C 
BRANCH  16  17
ATOM     17  N   LIG    1        2.470  -0.993   0.542  0.00  0.00    -0.295 NA
ATOM     18  C   LIG    1        3.861  -1.262   0.964  0.00  0.00    +0.120 C 
ATOM     19  C   LIG    1        4.905  -0.923  -0.078  0.00  0.00    -0.030 A 
ATOM     20  C   LIG    1        4.613  -0.044  -1.134  0.00  0.00    -0.042 A 
ATOM     21  C   LIG    1        5.606   0.280  -2.068  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1        6.891  -0.245  -1.940  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        7.191  -1.101  -0.883  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        3.215   0.490  -1.298  0.00  0.00    +0.051 C 
ATOM     25  C   LIG    1        6.204  -1.437   0.045  0.00  0.00    +0.005 A 
ATOM     26  C   LIG    1        2.373   0.361  -0.020  0.00  0.00    +0.089 C 
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7