REMARK  Name = BDB018692
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -4.552   1.195  -0.327  0.00  0.00    -0.265 N 
ATOM      2  C   LIG    1       -3.087   1.039  -0.066  0.00  0.00    +0.174 C 
ATOM      3  C   LIG    1       -2.810  -0.475   0.054  0.00  0.00    +0.205 C 
ATOM      4  C   LIG    1       -2.234  -1.003  -1.279  0.00  0.00    +0.263 C 
ATOM      5  O   LIG    1       -2.909  -1.418  -2.216  0.00  0.00    -0.271 OA
ATOM      6  N   LIG    1       -0.870  -0.897  -1.388  0.00  0.00    -0.278 N 
ATOM      7  H   LIG    1       -0.452  -1.134  -2.279  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1       -0.085  -0.614  -0.268  0.00  0.00    +0.096 A 
ATOM      9  C   LIG    1       -0.663  -0.524   0.998  0.00  0.00    +0.238 A 
ATOM     10  N   LIG    1        0.040  -0.278   2.116  0.00  0.00    -0.219 NA
ATOM     11  C   LIG    1        1.378  -0.114   1.965  0.00  0.00    +0.123 A 
ATOM     12  C   LIG    1        2.064  -0.188   0.749  0.00  0.00    +0.002 A 
ATOM     13  C   LIG    1        1.291  -0.454  -0.391  0.00  0.00    +0.038 A 
ATOM     14  O   LIG    1       -2.002  -0.741   1.203  0.00  0.00    -0.457 OA
ATOM     15  C   LIG    1       -4.199  -1.056   0.323  0.00  0.00    +0.079 C 
ATOM     16  C   LIG    1       -5.145  -0.158  -0.454  0.00  0.00    +0.121 C 
ENDROOT
BRANCH  12  17
ATOM     17  C   LIG    1        3.519   0.001   0.668  0.00  0.00    -0.016 A 
ATOM     18  C   LIG    1        4.340  -0.953   0.044  0.00  0.00    +0.008 A 
ATOM     19  C   LIG    1        5.724  -0.773  -0.032  0.00  0.00    +0.001 A 
ATOM     20  C   LIG    1        6.310   0.365   0.513  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        5.515   1.324   1.136  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        4.131   1.143   1.213  0.00  0.00    +0.008 A 
ENDBRANCH  12  17
BRANCH   1  24
ATOM     23  N   LIG    1       -5.569   3.264  -1.283  0.00  0.00    -0.174 NA
ATOM     24  C   LIG    1       -5.104   2.304  -0.836  0.00  0.00    +0.169 C 
ENDBRANCH   1  24
TORSDOF 2