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
  2.4522653399135201 -0.0043891290249520  1.5683293905516082
  0.0053899424029582  0.0003931882058329 -0.0129583565412120
  2.3063351400213925  1.4197862002320949 -0.9626777354561312
  1.5783562978412384  0.0111611555779334  3.4745645846854298
  3.3539801962924720  0.0001302175100044 -0.3355786959183540
  3.6738579400584324  1.4010862806285838  2.6000159201816988
  1.2377280778103801  1.3958195146025587  0.5784640221812677
