F   LATTICE,NONEQUIV.ATOMS   3  226 Fm-3c                                      
MODE OF CALC=RELA unit=bohr                                                    
 26.063103 26.063103 26.063103 90.000000 90.000000 90.000000                   
ATOM   1: X=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 2          ISPLIT= 2
       1: X=0.75000000 Y=0.75000000 Z=0.75000000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.12072000 Z=0.18058000
          MULT=24          ISPLIT= 8
      -2: X=0.00000000 Y=0.87928000 Z=0.81942000
      -2: X=0.87928000 Y=0.00000000 Z=0.68058000
      -2: X=0.12072000 Y=0.00000000 Z=0.31942000
      -2: X=0.18058000 Y=0.00000000 Z=0.12072000
      -2: X=0.81942000 Y=0.00000000 Z=0.87928000
      -2: X=0.00000000 Y=0.87928000 Z=0.18058000
      -2: X=0.00000000 Y=0.12072000 Z=0.81942000
      -2: X=0.00000000 Y=0.18058000 Z=0.62072000
      -2: X=0.00000000 Y=0.81942000 Z=0.37928000
      -2: X=0.12072000 Y=0.00000000 Z=0.68058000
      -2: X=0.87928000 Y=0.00000000 Z=0.31942000
      -2: X=0.81942000 Y=0.00000000 Z=0.12072000
      -2: X=0.18058000 Y=0.00000000 Z=0.87928000
      -2: X=0.00000000 Y=0.81942000 Z=0.62072000
      -2: X=0.00000000 Y=0.18058000 Z=0.37928000
      -2: X=0.18058000 Y=0.87928000 Z=0.50000000
      -2: X=0.81942000 Y=0.12072000 Z=0.50000000
      -2: X=0.12072000 Y=0.18058000 Z=0.00000000
      -2: X=0.87928000 Y=0.81942000 Z=0.00000000
      -2: X=0.18058000 Y=0.12072000 Z=0.50000000
      -2: X=0.81942000 Y=0.87928000 Z=0.50000000
      -2: X=0.87928000 Y=0.18058000 Z=0.00000000
      -2: X=0.12072000 Y=0.81942000 Z=0.00000000
Cd         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  48.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM   3: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 2
       3: X=0.00000000 Y=0.00000000 Z=0.50000000
Cd         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  48.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000