REMARK  Name = BDB004543
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        3.764   0.343   0.924  0.00  0.00    +0.063 A 
ATOM      2  C   LIG    1        2.624  -0.308   0.404  0.00  0.00    +0.088 A 
ATOM      3  C   LIG    1        1.439   0.446   0.292  0.00  0.00    +0.041 A 
ATOM      4  C   LIG    1        0.315  -0.218  -0.244  0.00  0.00    +0.130 A 
ATOM      5  N   LIG    1        0.351  -1.510  -0.599  0.00  0.00    -0.220 NA
ATOM      6  C   LIG    1        1.512  -2.140  -0.446  0.00  0.00    +0.223 A 
ATOM      7  C   LIG    1        1.411   1.798   0.717  0.00  0.00    +0.013 A 
ATOM      8  C   LIG    1        2.542   2.418   1.230  0.00  0.00    +0.002 A 
ATOM      9  N   LIG    1        2.645  -1.605   0.024  0.00  0.00    -0.235 NA
ATOM     10  C   LIG    1        3.717   1.691   1.329  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   1  14
ATOM     11  N   LIG    1        5.208  -1.638   0.717  0.00  0.00    -0.325 N 
ATOM     12  H   LIG    1        6.094  -2.105   0.840  0.00  0.00    +0.145 HD
ATOM     13  H   LIG    1        4.410  -2.150   0.352  0.00  0.00    +0.145 HD
ATOM     14  C   LIG    1        5.090  -0.332   1.090  0.00  0.00    +0.244 C 
ATOM     15  O   LIG    1        6.060   0.262   1.549  0.00  0.00    -0.270 OA
ENDBRANCH   1  14
BRANCH   4  16
ATOM     16  N   LIG    1       -0.898   0.494  -0.400  0.00  0.00    -0.324 N 
ATOM     17  H   LIG    1       -0.699   1.307  -0.979  0.00  0.00    +0.148 HD
BRANCH  16  18
ATOM     18  C   LIG    1       -2.045  -0.273  -0.937  0.00  0.00    +0.086 C 
ATOM     19  C   LIG    1       -3.120   0.732  -1.435  0.00  0.00    +0.103 C 
ATOM     20  N   LIG    1       -3.736   1.458  -0.314  0.00  0.00    -0.314 NA
ATOM     21  H   LIG    1       -2.969   1.887   0.211  0.00  0.00    +0.122 HD
ATOM     22  C   LIG    1       -4.428   0.541   0.604  0.00  0.00    +0.081 C 
ATOM     23  C   LIG    1       -4.119  -0.944   0.397  0.00  0.00    +0.017 C 
ATOM     24  C   LIG    1       -2.630  -1.186   0.164  0.00  0.00    +0.025 C 
ENDBRANCH  16  18
ENDBRANCH   4  16
TORSDOF 3