REMARK  Name = BDB026677
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.552  -2.538   0.634  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        2.216  -2.856   0.911  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        1.253  -1.837   0.872  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1       -0.093  -1.935   1.058  0.00  0.00    -0.223 NA
ATOM      5  C   LIG    1       -0.579  -0.709   0.941  0.00  0.00    +0.202 A 
ATOM      6  N   LIG    1        0.436   0.197   0.627  0.00  0.00    -0.288 N 
ATOM      7  C   LIG    1        1.629  -0.527   0.596  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        2.962  -0.196   0.297  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        3.917  -1.221   0.336  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1        0.300   1.582   0.318  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -0.771   2.028  -0.468  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -0.890   3.387  -0.789  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -2.084   3.906  -1.542  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -1.736   5.155  -2.334  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -0.974   6.161  -1.503  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -0.071   5.654  -0.607  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1        0.521   6.335  -0.149  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -1.075   7.372  -1.681  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1        0.058   4.295  -0.307  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1        1.113   3.861   0.492  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1        1.240   2.504   0.799  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   5  22
ATOM     22  C   LIG    1       -1.969  -0.372   1.254  0.00  0.00    +0.283 C 
ATOM     23  N   LIG    1       -2.970  -1.316   0.991  0.00  0.00    -0.291 N 
ATOM     24  C   LIG    1       -2.748  -2.622   0.359  0.00  0.00    +0.136 C 
ATOM     25  C   LIG    1       -4.052  -3.411   0.189  0.00  0.00    +0.179 C 
ATOM     26  O   LIG    1       -5.060  -2.667  -0.505  0.00  0.00    -0.377 OA
ATOM     27  C   LIG    1       -5.190  -1.307  -0.061  0.00  0.00    +0.179 C 
ATOM     28  C   LIG    1       -4.374  -0.957   1.188  0.00  0.00    +0.136 C 
ATOM     29  O   LIG    1       -2.276   0.724   1.726  0.00  0.00    -0.267 OA
ENDBRANCH   5  22
BRANCH   1  33
ATOM     30  C   LIG    1        6.613  -4.570  -0.262  0.00  0.00    +0.128 C 
ATOM     31  N   LIG    1        5.652  -3.502  -0.146  0.00  0.00    -0.314 N 
ATOM     32  H   LIG    1        5.613  -2.825  -0.896  0.00  0.00    +0.149 HD
ATOM     33  C   LIG    1        4.554  -3.639   0.679  0.00  0.00    +0.244 C 
ATOM     34  O   LIG    1        4.364  -4.614   1.397  0.00  0.00    -0.270 OA
ENDBRANCH   1  33
TORSDOF 3