Li
 1.0000000000000000
     0.0000000000000000    2.2730990194712701    2.2730990194712701
     2.2730990194712701    0.0000000000000000    2.2730990194712701
     2.2730990194712701    2.2730990194712701    0.0000000000000000
 Li 
   1
Cartesian
  0.0000000000000000  0.0000000000000000  0.0000000000000000