P   LATTICE,NONEQUIV.ATOMS   2  221 Pm-3m   
MODE OF CALC=RELA unit=bohr
  7.781892  7.781892  7.781892 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT=15
Lu         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  71.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.21000000 Y=0.50000000 Z=0.50000000
          MULT= 6          ISPLIT=15
      -2: X=0.79000000 Y=0.50000000 Z=0.50000000
      -2: X=0.50000000 Y=0.21000000 Z=0.50000000
      -2: X=0.50000000 Y=0.79000000 Z=0.50000000
      -2: X=0.50000000 Y=0.50000000 Z=0.21000000
      -2: X=0.50000000 Y=0.50000000 Z=0.79000000
B          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   5.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000