REMARK  Name = BDB000105
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -4.989   2.103  -0.364  0.00  0.00    +0.109 C 
ATOM      2  C   LIG    1       -5.125   0.606  -0.260  0.00  0.00    +0.213 C 
ATOM      3  N   LIG    1       -3.957  -0.110  -0.166  0.00  0.00    -0.291 N 
ATOM      4  C   LIG    1       -2.586   0.460  -0.159  0.00  0.00    +0.148 C 
ATOM      5  C   LIG    1       -1.775  -0.753  -0.042  0.00  0.00    +0.034 A 
ATOM      6  C   LIG    1       -2.570  -1.897   0.012  0.00  0.00    +0.087 A 
ATOM      7  N   LIG    1       -1.883  -3.028   0.119  0.00  0.00    -0.175 NA
ATOM      8  N   LIG    1       -0.600  -2.578   0.131  0.00  0.00    -0.263 N 
ATOM      9  H   LIG    1        0.169  -3.241   0.198  0.00  0.00    +0.190 HD
ATOM     10  C   LIG    1       -0.487  -1.199   0.038  0.00  0.00    +0.126 A 
ATOM     11  C   LIG    1       -4.008  -1.594  -0.061  0.00  0.00    +0.165 C 
ATOM     12  O   LIG    1       -6.230   0.068  -0.260  0.00  0.00    -0.276 OA
ENDROOT
BRANCH  10  13
ATOM     13  N   LIG    1        0.711  -0.513   0.036  0.00  0.00    -0.266 N 
ATOM     14  H   LIG    1        0.682   0.491  -0.073  0.00  0.00    +0.157 HD
ATOM     15  C   LIG    1        1.924  -1.182   0.092  0.00  0.00    +0.249 C 
ATOM     16  O   LIG    1        2.051  -2.403   0.113  0.00  0.00    -0.270 OA
BRANCH  15  17
ATOM     17  C   LIG    1        3.140  -0.322   0.094  0.00  0.00    +0.037 A 
ATOM     18  C   LIG    1        3.158   0.941   0.701  0.00  0.00    +0.014 A 
ATOM     19  C   LIG    1        4.328   1.708   0.683  0.00  0.00    +0.019 A 
ATOM     20  C   LIG    1        5.487   1.217   0.069  0.00  0.00    +0.052 A 
ATOM     21  C   LIG    1        5.473  -0.051  -0.522  0.00  0.00    +0.019 A 
ATOM     22  C   LIG    1        4.306  -0.820  -0.505  0.00  0.00    +0.014 A 
BRANCH  20  23
ATOM     23  C   LIG    1        6.683   2.007   0.054  0.00  0.00    +0.099 C 
ATOM     24  N   LIG    1        7.646   2.654   0.041  0.00  0.00    -0.191 NA
ENDBRANCH  20  23
ENDBRANCH  15  17
ENDBRANCH  10  13
TORSDOF 3