REMARK  Name = BDB052293
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.834   0.022  -0.140  0.00  0.00    -0.239 N 
ATOM      2  N   LIG    1       -1.951  -0.762  -0.115  0.00  0.00    -0.166 NA
ATOM      3  C   LIG    1       -2.994   0.077   0.044  0.00  0.00    +0.105 A 
ATOM      4  C   LIG    1       -2.494   1.424   0.119  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1       -3.227   2.594   0.281  0.00  0.00    +0.011 A 
ATOM      6  C   LIG    1       -4.607   2.325   0.372  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -5.164   1.010   0.305  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1       -4.383  -0.163   0.139  0.00  0.00    +0.064 A 
ATOM      9  C   LIG    1       -1.136   1.360   0.001  0.00  0.00    +0.123 A 
ENDROOT
BRANCH   1  12
ATOM     10  C   LIG    1        2.882  -0.376  -0.487  0.00  0.00    -0.032 A 
ATOM     11  C   LIG    1        1.619   0.221  -0.327  0.00  0.00    +0.032 A 
ATOM     12  C   LIG    1        0.456  -0.566  -0.298  0.00  0.00    +0.066 A 
ATOM     13  C   LIG    1        0.566  -1.959  -0.427  0.00  0.00    +0.028 A 
ATOM     14  C   LIG    1        1.818  -2.556  -0.578  0.00  0.00    +0.002 A 
ATOM     15  C   LIG    1        2.968  -1.770  -0.606  0.00  0.00    +0.005 A 
BRANCH  10  16
ATOM     16  C   LIG    1        4.138   0.465  -0.512  0.00  0.00    +0.116 C 
BRANCH  16  18
ATOM     17  C   LIG    1        6.089   1.133   0.726  0.00  0.00    +0.101 C 
ATOM     18  N   LIG    1        4.906   0.286   0.717  0.00  0.00    -0.315 NA
ATOM     19  H   LIG    1        4.315   0.515   1.516  0.00  0.00    +0.122 HD
ENDBRANCH  16  18
ENDBRANCH  10  16
ENDBRANCH   1  12
BRANCH   8  20
ATOM     20  C   LIG    1       -5.007  -1.495   0.076  0.00  0.00    +0.244 C 
ATOM     21  O   LIG    1       -6.221  -1.632   0.165  0.00  0.00    -0.270 OA
ATOM     22  N   LIG    1       -4.181  -2.568  -0.084  0.00  0.00    -0.325 N 
ATOM     23  H   LIG    1       -4.580  -3.494  -0.130  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1       -3.173  -2.448  -0.156  0.00  0.00    +0.145 HD
ENDBRANCH   8  20
TORSDOF 4