H   LATTICE,NONEQUIV.ATOMS   6  176 P63/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 11.485000 11.485000 28.980840 90.000000 90.000000120.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -1: X=0.00000000 Y=0.00000000 Z=0.75000000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     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  -2: X=0.33333333 Y=0.66666667 Z=0.61620000
          MULT= 4          ISPLIT= 4
      -2: X=0.66666667 Y=0.33333333 Z=0.38380000
      -2: X=0.66666666 Y=0.33333333 Z=0.11620000
      -2: X=0.33333334 Y=0.66666667 Z=0.88380000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     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=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -3: X=0.00000000 Y=0.00000000 Z=0.50000000
Sr         NPT=  781  R0=.000010000 RMT= 2.27        Z:  38.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.33333333 Y=0.66666667 Z=0.15380000
          MULT= 4          ISPLIT= 4
      -4: X=0.66666667 Y=0.33333333 Z=0.84620000
      -4: X=0.66666666 Y=0.33333333 Z=0.65380000
      -4: X=0.33333334 Y=0.66666667 Z=0.34620000
Ta         NPT=  781  R0=.000005000 RMT= 1.90        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  -5: X=0.04500000 Y=0.47770000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -5: X=0.95500000 Y=0.52230000 Z=0.75000000
      -5: X=0.56730000 Y=0.04500000 Z=0.75000000
      -5: X=0.43270000 Y=0.95500000 Z=0.25000000
      -5: X=0.52230000 Y=0.56730000 Z=0.25000000
      -5: X=0.47770000 Y=0.43270000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.64        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=0.23760000 Y=0.35670000 Z=0.09680000
          MULT=12          ISPLIT= 8
      -6: X=0.76240000 Y=0.64330000 Z=0.90320000
      -6: X=0.88090000 Y=0.23760000 Z=0.59680000
      -6: X=0.11910000 Y=0.76240000 Z=0.40320000
      -6: X=0.64330000 Y=0.88090000 Z=0.09680000
      -6: X=0.35670000 Y=0.11910000 Z=0.90320000
      -6: X=0.76240000 Y=0.64330000 Z=0.59680000
      -6: X=0.23760000 Y=0.35670000 Z=0.40320000
      -6: X=0.11910000 Y=0.76240000 Z=0.09680000
      -6: X=0.88090000 Y=0.23760000 Z=0.90320000
      -6: X=0.35670000 Y=0.11910000 Z=0.59680000
      -6: X=0.64330000 Y=0.88090000 Z=0.40320000
O          NPT=  781  R0=.000100000 RMT= 1.64        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000