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
  2.4670282770956939  0.0034937890840140  1.5783262071167248
 -0.0021107393352051 -0.0028871996558769 -0.0050824031959209
  2.3083314233487999  1.4175725245354609 -0.9751746020846679
  1.5540889898703270 -0.0061119720079454  3.4750997226681548
  3.3561959683482399 -0.0054422222496185 -0.2935483336013262
  3.6717632274244378  1.4331505020670781  2.5879437931994560
  1.2288015363127407  1.4063044366983521  0.5850290706768932
