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
  2.4772252863006430 -0.0063134909496258  1.5941880626708489
  0.0115026199796945  0.0025683024748189 -0.0010685498679476
  2.2899036253653269  1.4142968207316176 -0.9705973017727118
  1.5413719471540086 -0.0190270437940704  3.4713890849054074
  3.3557636614800801 -0.0071417670632573 -0.2957639326222353
  3.6716995741787262  1.4128486461135286  2.5943961885854212
  1.2396943611679918  1.4174477886669075  0.5689678960420999
