Fe1
1.0
  -1.3998417505439416    1.3998417505439418    1.3998417505439418
   1.3998417505439416   -1.3998417505439418    1.3998417505439418
   1.3998417505439418    1.3998417505439418   -1.3998417505439416
Fe
1
direct
   0.0000000000000000    0.0000000000000000    0.0000000000000000 Fe
