REMARK  Name = BDB026674
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.666   1.271  -0.000  0.00  0.00    +0.225 A 
ATOM      2  N   LIG    1        0.102   0.024   0.268  0.00  0.00    -0.287 N 
ATOM      3  C   LIG    1        1.156  -0.885   0.355  0.00  0.00    +0.074 A 
ATOM      4  C   LIG    1        2.296  -0.132   0.098  0.00  0.00    +0.091 A 
ATOM      5  C   LIG    1        3.563  -0.736   0.093  0.00  0.00    +0.043 A 
ATOM      6  C   LIG    1        3.655  -2.115   0.319  0.00  0.00    +0.039 A 
ATOM      7  C   LIG    1        2.498  -2.867   0.556  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1        1.229  -2.273   0.563  0.00  0.00    +0.029 A 
ATOM      9  N   LIG    1        1.982   1.173  -0.136  0.00  0.00    -0.221 NA
ENDROOT
BRANCH   2  10
ATOM     10  C   LIG    1       -1.279  -0.302   0.387  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -2.214   0.241  -0.504  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -3.569  -0.101  -0.395  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -4.606   0.547  -1.270  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -5.802  -0.366  -1.479  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -6.293  -0.964  -0.181  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -5.334  -1.303   0.737  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -5.663  -1.819   1.543  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -7.477  -1.230   0.015  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.981  -0.978   0.613  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1       -3.059  -1.508   1.512  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -1.706  -1.179   1.395  0.00  0.00    +0.028 A 
ENDBRANCH   2  10
BRANCH   6  22
ATOM     22  C   LIG    1        4.966  -2.821   0.329  0.00  0.00    +0.244 C 
ATOM     23  N   LIG    1        5.979  -2.252  -0.415  0.00  0.00    -0.314 N 
ATOM     24  H   LIG    1        5.748  -1.541  -1.095  0.00  0.00    +0.149 HD
ATOM     25  C   LIG    1        7.248  -2.921  -0.556  0.00  0.00    +0.128 C 
ATOM     26  O   LIG    1        5.093  -3.870   0.952  0.00  0.00    -0.270 OA
ENDBRANCH   6  22
BRANCH   1  27
ATOM     27  C   LIG    1       -0.015   2.555  -0.018  0.00  0.00    +0.375 C 
ATOM     28  O   LIG    1       -1.143   2.787   0.400  0.00  0.00    -0.241 OA
BRANCH  27  29
ATOM     29  O   LIG    1        0.799   3.503  -0.572  0.00  0.00    -0.459 OA
BRANCH  29  31
ATOM     30  C   LIG    1        0.546   5.566   0.670  0.00  0.00    +0.048 C 
ATOM     31  C   LIG    1        0.273   4.836  -0.631  0.00  0.00    +0.229 C 
ENDBRANCH  29  31
ENDBRANCH  27  29
ENDBRANCH   1  27
TORSDOF 5