R   LATTICE,NONEQUIV.ATOMS   6  167 R-3c                                       
MODE OF CALC=RELA unit=bohr                                                    
 11.854631 11.854631 69.650583 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= 1.96        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=0.88364000 Y=0.61636000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.11636000 Y=0.38364000 Z=0.75000000
      -2: X=0.61636000 Y=0.25000000 Z=0.88364000
      -2: X=0.38364000 Y=0.75000000 Z=0.11636000
      -2: X=0.25000000 Y=0.88364000 Z=0.61636000
      -2: X=0.75000000 Y=0.11636000 Z=0.38364000
Ta         NPT=  781  R0=.000005000 RMT= 1.96        Z:  73.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.17418000 Y=0.17418000 Z=0.17418000
          MULT= 4          ISPLIT= 4
      -3: X=0.82582000 Y=0.82582000 Z=0.82582000
      -3: X=0.67418000 Y=0.67418000 Z=0.67418000
      -3: X=0.32582000 Y=0.32582000 Z=0.32582000
K          NPT=  781  R0=.000050000 RMT= 2.50        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  -4: X=0.06865000 Y=0.26665000 Z=0.75965000
          MULT=12          ISPLIT= 8
      -4: X=0.93135000 Y=0.73335000 Z=0.24035000
      -4: X=0.26665000 Y=0.75965000 Z=0.06865000
      -4: X=0.73335000 Y=0.24035000 Z=0.93135000
      -4: X=0.56865000 Y=0.25965000 Z=0.76665000
      -4: X=0.43135000 Y=0.74035000 Z=0.23335000
      -4: X=0.75965000 Y=0.06865000 Z=0.26665000
      -4: X=0.24035000 Y=0.93135000 Z=0.73335000
      -4: X=0.25965000 Y=0.76665000 Z=0.56865000
      -4: X=0.74035000 Y=0.23335000 Z=0.43135000
      -4: X=0.76665000 Y=0.56865000 Z=0.25965000
      -4: X=0.23335000 Y=0.43135000 Z=0.74035000
O          NPT=  781  R0=.000100000 RMT= 1.69        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.09377000 Y=0.09377000 Z=0.09377000
          MULT= 4          ISPLIT= 4
      -5: X=0.90623000 Y=0.90623000 Z=0.90623000
      -5: X=0.59377000 Y=0.59377000 Z=0.59377000
      -5: X=0.40623000 Y=0.40623000 Z=0.40623000
O          NPT=  781  R0=.000100000 RMT= 1.69        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.49667000 Y=0.00333000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -6: X=0.50333000 Y=0.99667000 Z=0.75000000
      -6: X=0.00333000 Y=0.25000000 Z=0.49667000
      -6: X=0.99667000 Y=0.75000000 Z=0.50333000
      -6: X=0.25000000 Y=0.49667000 Z=0.00333000
      -6: X=0.75000000 Y=0.50333000 Z=0.99667000
O          NPT=  781  R0=.000100000 RMT= 1.69        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000