Ni1 O2                                  
   1.00000000000000     
     5.4246532509168635   -0.3410018074948019   -0.2019679622092504
     4.8902994120237535    2.3723661349157306   -0.2019679994096439
     4.8903004086715534    0.9630670845207432    2.1774784300847956
   Ni   O 
     1     2
Direct
  0.0013702570472983  0.0013702570471585  0.0013702570469180
  0.6075218843970883  0.6075218844144896  0.6075218844444129
  0.3952218585556146  0.3952218585383533  0.3952218585086704
 
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
  0.00000000E+00  0.00000000E+00  0.00000000E+00
