P   LATTICE,NONEQUIV.ATOMS   4  137 P42/nmc 
MODE OF CALC=RELA unit=bohr
 10.231922 10.231922 29.729549 90.000000 90.000000 90.000000
ATOM  -1: X=0.75000000 Y=0.25000000 Z=0.75000000
          MULT= 2          ISPLIT=15
      -1: X=0.25000000 Y=0.75000000 Z=0.25000000
U          NPT=  781  R0=.000005000 RMT=   2.00000   Z:  92.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.75000000 Y=0.25000000 Z=0.11548000
          MULT= 4          ISPLIT=15
      -2: X=0.25000000 Y=0.75000000 Z=0.88452000
      -2: X=0.25000000 Y=0.75000000 Z=0.61548000
      -2: X=0.75000000 Y=0.25000000 Z=0.38452000
Ba         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  56.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.25000000 Y=0.55774000 Z=0.08342000
          MULT= 8          ISPLIT=15
      -3: X=0.75000000 Y=0.44226000 Z=0.91658000
      -3: X=0.94226000 Y=0.25000000 Z=0.58342000
      -3: X=0.05774000 Y=0.75000000 Z=0.41658000
      -3: X=0.25000000 Y=0.94226000 Z=0.08342000
      -3: X=0.75000000 Y=0.05774000 Z=0.91658000
      -3: X=0.55774000 Y=0.25000000 Z=0.58342000
      -3: X=0.44226000 Y=0.75000000 Z=0.41658000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.25000000 Y=0.25000000 Z=0.27409000
          MULT= 4          ISPLIT=15
      -4: X=0.75000000 Y=0.75000000 Z=0.72591000
      -4: X=0.25000000 Y=0.25000000 Z=0.77409000
      -4: X=0.75000000 Y=0.75000000 Z=0.22591000
S          NPT=  781  R0=.000100000 RMT=   2.00000   Z:  16.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000