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
  2.4425329066446739  0.0198334903214498  1.5808885052141242
 -0.0014984490180644 -0.0005432737051827  0.0113925963203317
  2.3017010701697158  1.3859043208290933 -0.9774557150077193
  1.5687033428084538 -0.0105837483272939  3.4792847956749786
  3.3416063404466994  0.0014741766510516 -0.3231450606511550
  3.6717105855997327  1.4239398403924104  2.5964100536511272
  1.2291166680385275  1.4284874767758780  0.5750778593077094
