REMARK  Name = BDB018494
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.222  -1.723  -0.688  0.00  0.00    -0.001 A 
ATOM      2  C   LIG    1        0.945  -2.214  -0.139  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        0.735  -3.544  -0.119  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1        1.672  -4.454  -0.577  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        1.361  -5.874  -0.494  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1        2.904  -4.061  -1.086  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1        3.777  -4.820  -1.492  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1        3.144  -2.596  -1.132  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1        3.027   2.392  -0.927  0.00  0.00    +0.215 A 
ATOM     10  N   LIG    1        3.701   1.668  -0.021  0.00  0.00    -0.222 NA
ATOM     11  C   LIG    1        3.457   0.342   0.015  0.00  0.00    +0.124 A 
ATOM     12  C   LIG    1        2.556  -0.295  -0.811  0.00  0.00    +0.019 A 
ATOM     13  C   LIG    1        1.928   0.539  -1.713  0.00  0.00    +0.124 A 
ATOM     14  N   LIG    1        2.140   1.869  -1.785  0.00  0.00    -0.222 NA
BRANCH   9  16
ATOM     15  C   LIG    1        3.405   4.415   0.265  0.00  0.00    +0.128 C 
ATOM     16  N   LIG    1        3.208   3.764  -1.013  0.00  0.00    -0.317 N 
ATOM     17  H   LIG    1        2.421   4.115  -1.548  0.00  0.00    +0.149 HD
ENDBRANCH   9  16
ENDBRANCH   1  12
BRANCH   2  18
ATOM     18  C   LIG    1       -0.046  -1.303   0.352  0.00  0.00    +0.022 A 
ATOM     19  C   LIG    1       -1.352  -1.204  -0.074  0.00  0.00    +0.123 A 
ATOM     20  N   LIG    1       -1.930  -0.150   0.612  0.00  0.00    -0.239 N 
ATOM     21  N   LIG    1       -1.033   0.421   1.450  0.00  0.00    -0.174 NA
ATOM     22  C   LIG    1        0.081  -0.300   1.323  0.00  0.00    +0.143 A 
BRANCH  20  23
ATOM     23  C   LIG    1       -3.264   0.342   0.516  0.00  0.00    +0.077 A 
ATOM     24  C   LIG    1       -3.689   1.555   1.107  0.00  0.00    +0.063 A 
ATOM     25  C   LIG    1       -5.064   1.886   1.047  0.00  0.00    +0.015 A 
ATOM     26  C   LIG    1       -5.991   1.066   0.406  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1       -5.565  -0.106  -0.197  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1       -4.217  -0.469  -0.142  0.00  0.00    +0.028 A 
BRANCH  24  29
ATOM     29  C   LIG    1       -2.862   2.645   1.731  0.00  0.00    +0.259 C 
ATOM     30  N   LIG    1       -1.628   2.939   1.096  0.00  0.00    -0.219 N 
ATOM     31  H   LIG    1       -1.095   2.111   0.810  0.00  0.00    +0.167 HD
ATOM     32  O   LIG    1       -3.329   3.311   2.647  0.00  0.00    -0.269 OA
BRANCH  30  33
ATOM     33  C   LIG    1       -0.967   3.941   1.677  0.00  0.00    +0.173 C 
ATOM     34  N   LIG    1       -0.326   4.795   2.125  0.00  0.00    -0.174 NA
ENDBRANCH  30  33
ENDBRANCH  24  29
ENDBRANCH  20  23
ENDBRANCH   2  18
TORSDOF 6