H   LATTICE,NONEQUIV.ATOMS   6  182 P6322                                      
MODE OF CALC=RELA unit=bohr                                                    
 11.818914 11.818914 23.304103 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -1: X=0.66666666 Y=0.33333333 Z=0.75000000
Sr         NPT=  781  R0=.000010000 RMT= 2.36        Z:  38.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.33333333 Y=0.66666667 Z=0.75000000
          MULT= 2          ISPLIT= 4
      -2: X=0.66666666 Y=0.33333333 Z=0.25000000
Ta         NPT=  781  R0=.000005000 RMT= 1.97        Z:  73.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.64300000 Y=0.00000000 Z=0.00000000
          MULT= 6          ISPLIT= 8
      -3: X=0.64300000 Y=0.64300000 Z=0.50000000
      -3: X=0.00000000 Y=0.35700000 Z=0.50000000
      -3: X=0.00000000 Y=0.64300000 Z=0.00000000
      -3: X=0.35700000 Y=0.00000000 Z=0.50000000
      -3: X=0.35700000 Y=0.35700000 Z=0.00000000
Ta         NPT=  781  R0=.000005000 RMT= 1.97        Z:  73.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.33333333 Y=0.66666667 Z=0.03470000
          MULT= 4          ISPLIT= 4
      -4: X=0.66666666 Y=0.33333333 Z=0.53470000
      -4: X=0.33333333 Y=0.66666667 Z=0.46530000
      -4: X=0.66666666 Y=0.33333333 Z=0.96530000
O          NPT=  781  R0=.000100000 RMT= 1.70        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=0.24680000 Y=0.00000000 Z=0.00000000
          MULT= 6          ISPLIT= 8
      -5: X=0.24680000 Y=0.24680000 Z=0.50000000
      -5: X=0.00000000 Y=0.75320000 Z=0.50000000
      -5: X=0.00000000 Y=0.24680000 Z=0.00000000
      -5: X=0.75320000 Y=0.00000000 Z=0.50000000
      -5: X=0.75320000 Y=0.75320000 Z=0.00000000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -6: X=0.43150000 Y=0.06140000 Z=0.34540000
          MULT=12          ISPLIT= 8
      -6: X=0.37010000 Y=0.43150000 Z=0.84540000
      -6: X=0.93860000 Y=0.56850000 Z=0.15460000
      -6: X=0.93860000 Y=0.37010000 Z=0.34540000
      -6: X=0.37010000 Y=0.93860000 Z=0.65460000
      -6: X=0.56850000 Y=0.93860000 Z=0.84540000
      -6: X=0.43150000 Y=0.37010000 Z=0.15460000
      -6: X=0.62990000 Y=0.56850000 Z=0.34540000
      -6: X=0.06140000 Y=0.43150000 Z=0.65460000
      -6: X=0.06140000 Y=0.62990000 Z=0.84540000
      -6: X=0.62990000 Y=0.06140000 Z=0.15460000
      -6: X=0.56850000 Y=0.62990000 Z=0.65460000
O          NPT=  781  R0=.000100000 RMT= 1.70        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000