H   LATTICE,NONEQUIV.ATOMS   5  194 P63/mmc                                    
MODE OF CALC=RELA unit=bohr                                                    
 14.337352 14.337352 33.958379 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
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
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=0.56887000
          MULT= 4          ISPLIT= 4
      -2: X=0.66666667 Y=0.33333333 Z=0.43113000
      -2: X=0.66666666 Y=0.33333333 Z=0.06887000
      -2: X=0.33333334 Y=0.66666667 Z=0.93113000
Rb         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  37.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.33333333 Y=0.66666667 Z=0.17375000
          MULT= 4          ISPLIT= 4
      -3: X=0.66666667 Y=0.33333333 Z=0.82625000
      -3: X=0.66666666 Y=0.33333333 Z=0.67375000
      -3: X=0.33333334 Y=0.66666667 Z=0.32625000
Nb         NPT=  781  R0=.000010000 RMT= 2.43        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.50596000 Y=0.01192000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -4: X=0.49404000 Y=0.98808000 Z=0.75000000
      -4: X=0.49404000 Y=0.50596000 Z=0.75000000
      -4: X=0.50596000 Y=0.49404000 Z=0.25000000
      -4: X=0.01192000 Y=0.50596000 Z=0.75000000
      -4: X=0.98808000 Y=0.49404000 Z=0.25000000
Br         NPT=  781  R0=.000050000 RMT= 2.43        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000 0.8660254 0.5000000
                     0.0000000-0.5000000 0.8660254
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.17122000 Y=0.34244000 Z=0.09188000
          MULT=12          ISPLIT= 8
      -5: X=0.82878000 Y=0.65756000 Z=0.90812000
      -5: X=0.82878000 Y=0.17122000 Z=0.59188000
      -5: X=0.17122000 Y=0.82878000 Z=0.40812000
      -5: X=0.34244000 Y=0.17122000 Z=0.59188000
      -5: X=0.65756000 Y=0.82878000 Z=0.40812000
      -5: X=0.65756000 Y=0.82878000 Z=0.09188000
      -5: X=0.34244000 Y=0.17122000 Z=0.90812000
      -5: X=0.82878000 Y=0.65756000 Z=0.59188000
      -5: X=0.17122000 Y=0.34244000 Z=0.40812000
      -5: X=0.17122000 Y=0.82878000 Z=0.09188000
      -5: X=0.82878000 Y=0.17122000 Z=0.90812000
Br         NPT=  781  R0=.000050000 RMT= 2.43        Z:  35.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000