H   LATTICE,NONEQUIV.ATOMS   5  194 P63/mmc                                    
MODE OF CALC=RELA unit=bohr                                                    
 13.356395 13.356395 34.499974 90.000000 90.000000120.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -1: X=0.00000000 Y=0.00000000 Z=0.50000000
Na         NPT=  781  R0=.000100000 RMT= 2.41        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  -2: X=0.33333333 Y=0.66666667 Z=0.56040000
          MULT= 4          ISPLIT= 4
      -2: X=0.66666667 Y=0.33333333 Z=0.43960000
      -2: X=0.66666666 Y=0.33333333 Z=0.06040000
      -2: X=0.33333334 Y=0.66666667 Z=0.93960000
Cs         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  55.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.17070000 Y=0.34140000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.82930000 Y=0.65860000 Z=0.75000000
      -3: X=0.82930000 Y=0.17070000 Z=0.75000000
      -3: X=0.17070000 Y=0.82930000 Z=0.25000000
      -3: X=0.34140000 Y=0.17070000 Z=0.75000000
      -3: X=0.65860000 Y=0.82930000 Z=0.25000000
Au         NPT=  781  R0=.000005000 RMT= 2.10        Z:  79.00000              
LOCAL ROT MATRIX:    0.0000000 0.8660254 0.5000000
                     0.0000000-0.5000000 0.8660254
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.16830000 Y=0.33660000 Z=0.14360000
          MULT=12          ISPLIT= 8
      -4: X=0.83170000 Y=0.66340000 Z=0.85640000
      -4: X=0.83170000 Y=0.16830000 Z=0.64360000
      -4: X=0.16830000 Y=0.83170000 Z=0.35640000
      -4: X=0.33660000 Y=0.16830000 Z=0.64360000
      -4: X=0.66340000 Y=0.83170000 Z=0.35640000
      -4: X=0.66340000 Y=0.83170000 Z=0.14360000
      -4: X=0.33660000 Y=0.16830000 Z=0.85640000
      -4: X=0.83170000 Y=0.66340000 Z=0.64360000
      -4: X=0.16830000 Y=0.33660000 Z=0.35640000
      -4: X=0.16830000 Y=0.83170000 Z=0.14360000
      -4: X=0.83170000 Y=0.16830000 Z=0.85640000
C          NPT=  781  R0=.000100000 RMT= 1.05        Z:   6.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.16460000 Y=0.32920000 Z=0.08110000
          MULT=12          ISPLIT= 8
      -5: X=0.83540000 Y=0.67080000 Z=0.91890000
      -5: X=0.83540000 Y=0.16460000 Z=0.58110000
      -5: X=0.16460000 Y=0.83540000 Z=0.41890000
      -5: X=0.32920000 Y=0.16460000 Z=0.58110000
      -5: X=0.67080000 Y=0.83540000 Z=0.41890000
      -5: X=0.67080000 Y=0.83540000 Z=0.08110000
      -5: X=0.32920000 Y=0.16460000 Z=0.91890000
      -5: X=0.83540000 Y=0.67080000 Z=0.58110000
      -5: X=0.16460000 Y=0.32920000 Z=0.41890000
      -5: X=0.16460000 Y=0.83540000 Z=0.08110000
      -5: X=0.83540000 Y=0.16460000 Z=0.91890000
N          NPT=  781  R0=.000100000 RMT= 1.10        Z:   7.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000