REMARK  Name = BDB005578
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.663  -0.239  -0.700  0.00  0.00    -0.029 A 
ATOM      2  C   LIG    1       -0.901  -1.054   0.156  0.00  0.00    +0.031 A 
ATOM      3  C   LIG    1        0.485  -0.898   0.249  0.00  0.00    +0.051 A 
ATOM      4  C   LIG    1        1.165   0.059  -0.517  0.00  0.00    +0.020 A 
ATOM      5  C   LIG    1        2.638   0.159  -0.388  0.00  0.00    +0.045 A 
ATOM      6  N   LIG    1        3.341   1.035  -1.213  0.00  0.00    -0.343 N 
ATOM      7  H   LIG    1        2.894   1.179  -2.114  0.00  0.00    +0.146 HD
ATOM      8  C   LIG    1        4.796   0.966  -1.304  0.00  0.00    +0.102 C 
ATOM      9  C   LIG    1        5.379   0.724   0.082  0.00  0.00    +0.023 C 
ATOM     10  C   LIG    1        4.767  -0.529   0.718  0.00  0.00    +0.044 C 
ATOM     11  C   LIG    1        3.277  -0.611   0.516  0.00  0.00    +0.038 A 
ATOM     12  C   LIG    1        2.543  -1.605   1.346  0.00  0.00    +0.254 A 
ATOM     13  O   LIG    1        3.118  -2.318   2.163  0.00  0.00    -0.268 OA
ATOM     14  C   LIG    1        0.402   0.890  -1.347  0.00  0.00    +0.012 A 
ATOM     15  N   LIG    1        1.197  -1.704   1.143  0.00  0.00    -0.322 N 
ATOM     16  H   LIG    1        0.712  -2.380   1.717  0.00  0.00    +0.169 HD
ATOM     17  C   LIG    1       -0.990   0.743  -1.439  0.00  0.00    +0.006 A 
ENDROOT
BRANCH   1  19
ATOM     18  C   LIG    1       -3.873   0.210  -1.960  0.00  0.00    +0.029 C 
ATOM     19  C   LIG    1       -3.179  -0.452  -0.755  0.00  0.00    +0.083 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -3.797  -0.148   0.556  0.00  0.00    -0.302 NA
ATOM     21  C   LIG    1       -5.120  -0.750   0.707  0.00  0.00    +0.105 C 
ATOM     22  C   LIG    1       -3.842   1.277   0.878  0.00  0.00    +0.105 C 
ENDBRANCH  19  20
ENDBRANCH   1  19
TORSDOF 2