R   LATTICE,NONEQUIV.ATOMS   4  167 R-3c                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.527822 18.527822 21.971845 90.000000 90.000000120.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
Ta         NPT=  781  R0=.000005000 RMT= 2.03        Z:  73.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.60127000 Y=0.89873000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.39873000 Y=0.10127000 Z=0.75000000
      -2: X=0.89873000 Y=0.25000000 Z=0.60127000
      -2: X=0.10127000 Y=0.75000000 Z=0.39873000
      -2: X=0.25000000 Y=0.60127000 Z=0.89873000
      -2: X=0.75000000 Y=0.39873000 Z=0.10127000
Sr         NPT=  781  R0=.000010000 RMT= 2.38        Z:  38.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -3: X=0.75000000 Y=0.75000000 Z=0.75000000
Na         NPT=  781  R0=.000100000 RMT= 2.26        Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.27770000 Y=0.94510000 Z=0.07390000
          MULT=12          ISPLIT= 8
      -4: X=0.72230000 Y=0.05490000 Z=0.92610000
      -4: X=0.94510000 Y=0.07390000 Z=0.27770000
      -4: X=0.05490000 Y=0.92610000 Z=0.72230000
      -4: X=0.77770000 Y=0.57390000 Z=0.44510000
      -4: X=0.22230000 Y=0.42610000 Z=0.55490000
      -4: X=0.07390000 Y=0.27770000 Z=0.94510000
      -4: X=0.92610000 Y=0.72230000 Z=0.05490000
      -4: X=0.57390000 Y=0.44510000 Z=0.77770000
      -4: X=0.42610000 Y=0.55490000 Z=0.22230000
      -4: X=0.44510000 Y=0.77770000 Z=0.57390000
      -4: X=0.55490000 Y=0.22230000 Z=0.42610000
O          NPT=  781  R0=.000100000 RMT= 1.74        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000