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
  2.4438998431649730 -0.0049885291624302  1.5809329495457485
 -0.0016093956165422  0.0136553372396014  0.0105535993926507
  2.3086513491207596  1.4141664577926134 -0.9827911354847454
  1.5706692982880157  0.0152616870580145  3.4865385686623043
  3.3452630289428793  0.0022758705550885 -0.3019441676812135
  3.6528423806200148  1.4220846043608706  2.5821748419319355
  1.2541602653202955  1.4229626803970792  0.5774730989248039
