REMARK  Name = BDB025290
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -3.573  -0.161  -0.801  0.00  0.00    -0.313 N 
ATOM      2  C   LIG    1       -3.324   0.312   0.462  0.00  0.00    +0.142 A 
ATOM      3  C   LIG    1       -1.975   0.118   0.741  0.00  0.00    +0.027 A 
ATOM      4  C   LIG    1       -1.521   0.559   2.000  0.00  0.00    +0.013 A 
ATOM      5  C   LIG    1       -2.440   1.145   2.870  0.00  0.00    +0.020 A 
ATOM      6  C   LIG    1       -3.757   1.266   2.464  0.00  0.00    +0.113 A 
ATOM      7  C   LIG    1       -1.389  -0.527  -0.400  0.00  0.00    +0.012 A 
ATOM      8  C   LIG    1       -0.078  -0.988  -0.717  0.00  0.00    -0.038 A 
ATOM      9  C   LIG    1        0.130  -1.590  -1.977  0.00  0.00    +0.004 A 
ATOM     10  C   LIG    1       -0.904  -1.750  -2.889  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -2.190  -1.310  -2.588  0.00  0.00    +0.026 A 
ATOM     12  N   LIG    1       -4.249   0.862   1.274  0.00  0.00    -0.237 NA
ATOM     13  C   LIG    1       -2.414  -0.695  -1.345  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   1  20
ATOM     14  O   LIG    1       -8.120   0.119   1.116  0.00  0.00    -0.275 OA
ATOM     15  C   LIG    1       -7.186   0.001   0.327  0.00  0.00    +0.219 C 
ATOM     16  N   LIG    1       -6.773   1.060  -0.441  0.00  0.00    -0.255 N 
ATOM     17  H   LIG    1       -7.250   1.934  -0.271  0.00  0.00    +0.158 HD
ATOM     18  C   LIG    1       -5.659   1.139  -1.243  0.00  0.00    +0.242 C 
ATOM     19  O   LIG    1       -5.338   2.210  -1.759  0.00  0.00    -0.273 OA
ATOM     20  C   LIG    1       -4.875  -0.144  -1.468  0.00  0.00    +0.176 C 
ATOM     21  C   LIG    1       -5.724  -1.382  -1.171  0.00  0.00    +0.044 C 
ATOM     22  C   LIG    1       -6.417  -1.290   0.179  0.00  0.00    +0.099 C 
ENDBRANCH   1  20
BRANCH   8  23
ATOM     23  C   LIG    1        1.116  -0.853   0.205  0.00  0.00    +0.038 C 
BRANCH  23  24
ATOM     24  C   LIG    1        1.763   0.529   0.081  0.00  0.00    +0.033 C 
BRANCH  24  25
ATOM     25  C   LIG    1        2.918   0.710   1.063  0.00  0.00    +0.160 C 
BRANCH  25  26
ATOM     26  O   LIG    1        3.925  -0.291   0.939  0.00  0.00    -0.377 OA
BRANCH  26  27
ATOM     27  C   LIG    1        4.714  -0.241  -0.251  0.00  0.00    +0.188 C 
BRANCH  27  28
ATOM     28  C   LIG    1        5.508   1.058  -0.450  0.00  0.00    +0.188 C 
BRANCH  28  29
ATOM     29  O   LIG    1        6.226   1.508   0.696  0.00  0.00    -0.375 OA
BRANCH  29  30
ATOM     30  C   LIG    1        7.173   0.598   1.259  0.00  0.00    +0.187 C 
BRANCH  30  31
ATOM     31  C   LIG    1        8.302   0.178   0.314  0.00  0.00    +0.184 C 
BRANCH  31  32
ATOM     32  O   LIG    1        9.074   1.307  -0.084  0.00  0.00    -0.393 OA
ATOM     33  H   LIG    1        9.776   0.985  -0.673  0.00  0.00    +0.209 HD
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   8  23
TORSDOF 11