P   LATTICE,NONEQUIV.ATOMS   2  221 Pm-3m                                      
MODE OF CALC=RELA unit=bohr                                                    
  7.998266  7.998266  7.998266 90.000000 90.000000 90.000000                   
ATOM   1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 2
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=0.20800000 Y=0.50000000 Z=0.50000000
          MULT= 6          ISPLIT=-2
      -2: X=0.79200000 Y=0.50000000 Z=0.50000000
      -2: X=0.50000000 Y=0.20800000 Z=0.50000000
      -2: X=0.50000000 Y=0.79200000 Z=0.50000000
      -2: X=0.50000000 Y=0.50000000 Z=0.20800000
      -2: X=0.50000000 Y=0.50000000 Z=0.79200000
B          NPT=  781  R0=.000100000 RMT= 1.64        Z:   5.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000