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
  2.4488272419031616 -0.0116465478127594  1.5850582962153232
 -0.0021056805605223 -0.0013197985525297  0.0040248517985599
  2.3099195063016058  1.3984652251145597 -0.9580335493191697
  1.5784039168046731 -0.0003917679385607  3.4690089141489793
  3.3373474220574812  0.0040091707755282 -0.3105603010394847
  3.6767866380665537  1.4244618198371579  2.5818498137557269
  1.2351885773342153  1.4155171608290791  0.5674613479295518
