Li Ni  O 
 1.0000000000000000
     4.5996189999999997    0.0000000000000000   -1.9394070000000001
     0.0000000000000000    2.8279139999999998    0.0000000000000000
     0.3141910000000000    0.0000000000000000    5.1035729999999999
   1   2   4
Cartesian
  2.4547356195146142  0.0286471059029453  1.5674336273267051
  0.0049914038119212  0.0066670109923277  0.0163597265031202
  2.2997238005724312  1.3992703935171307 -0.9690517069391624
  1.5864805564217188 -0.0111310756430331  3.4757349741409542
  3.3361197636622557 -0.0184263532913410 -0.2998146634019866
  3.6814128477552384  1.4213938969344329  2.5938127240341680
  1.2426594982682850  1.4166803954626319  0.5608488733465806
