REMARK  Name = BDB026692
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.168   0.230  -0.154  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        3.405   1.404  -0.219  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.010   1.314  -0.111  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1        1.093   2.322  -0.119  0.00  0.00    -0.227 NA
ATOM      5  C   LIG    1       -0.091   1.749   0.001  0.00  0.00    +0.147 A 
ATOM      6  N   LIG    1        0.035   0.362   0.139  0.00  0.00    -0.292 N 
ATOM      7  C   LIG    1        1.397   0.074   0.048  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        2.153  -1.106   0.169  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        3.547  -1.006   0.056  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -1.009  -0.584   0.363  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -0.980  -1.830  -0.279  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -2.011  -2.755  -0.070  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -1.959  -4.130  -0.678  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -3.354  -4.687  -0.906  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -4.237  -4.520   0.309  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -4.080  -3.361   1.022  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -4.766  -3.196   1.748  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -5.119  -5.326   0.597  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.061  -2.433   0.795  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1       -3.087  -1.205   1.451  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -2.067  -0.276   1.229  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   5  22
ATOM     22  C   LIG    1       -1.351   2.507  -0.077  0.00  0.00    +0.023 A 
ATOM     23  C   LIG    1       -1.602   3.596   0.788  0.00  0.00    -0.012 A 
ATOM     24  C   LIG    1       -2.811   4.302   0.651  0.00  0.00    +0.006 A 
ATOM     25  C   LIG    1       -3.757   3.937  -0.308  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -3.502   2.871  -1.163  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -2.304   2.166  -1.054  0.00  0.00    +0.012 A 
BRANCH  23  28
ATOM     28  C   LIG    1       -0.568   4.044   1.797  0.00  0.00    +0.191 C 
BRANCH  28  29
ATOM     29  O   LIG    1       -1.161   4.793   2.856  0.00  0.00    -0.390 OA
ATOM     30  H   LIG    1       -0.425   5.101   3.411  0.00  0.00    +0.210 HD
ENDBRANCH  28  29
ENDBRANCH  23  28
ENDBRANCH   5  22
BRANCH   1  34
ATOM     31  C   LIG    1        7.722  -0.664  -1.076  0.00  0.00    +0.128 C 
ATOM     32  N   LIG    1        6.306  -0.732  -0.812  0.00  0.00    -0.314 N 
ATOM     33  H   LIG    1        5.767  -1.419  -1.321  0.00  0.00    +0.149 HD
ATOM     34  C   LIG    1        5.647   0.350  -0.264  0.00  0.00    +0.244 C 
ATOM     35  O   LIG    1        6.211   1.378   0.092  0.00  0.00    -0.270 OA
ENDBRANCH   1  34
TORSDOF 5