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
  2.4453656188659756 -0.0016791780252043  1.5730018851339698
 -0.0040115622119495  0.0011076156490873 -0.0106957641480535
  2.2863237435578885  1.4145999347892124 -0.9519886022390233
  1.5666317292786125  0.0041433022204573  3.4680421016023302
  3.3461875564930303  0.0084178866310143 -0.3102505714746444
  3.6754832487786704  1.4053272418502420  2.5916913354883317
  1.2492752133194338  1.4150722236640005  0.5608106477077738
