H   LATTICE,NONEQUIV.ATOMS   6  176 P63/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 19.458888 19.458888 13.358474 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.00630000
          MULT= 4          ISPLIT= 4
      -1: X=0.66666667 Y=0.33333333 Z=0.99370000
      -1: X=0.66666666 Y=0.33333333 Z=0.50630000
      -1: X=0.33333334 Y=0.66666667 Z=0.49370000
Pb         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  82.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.22840000 Y=0.26440000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.77160000 Y=0.73560000 Z=0.75000000
      -2: X=0.96400000 Y=0.22840000 Z=0.75000000
      -2: X=0.03600000 Y=0.77160000 Z=0.25000000
      -2: X=0.73560000 Y=0.96400000 Z=0.25000000
      -2: X=0.26440000 Y=0.03600000 Z=0.75000000
Pb         NPT=  781  R0=.000005000 RMT= 2.50000     Z:  82.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00630000 Y=0.40950000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.99370000 Y=0.59050000 Z=0.75000000
      -3: X=0.59680000 Y=0.00630000 Z=0.75000000
      -3: X=0.40320000 Y=0.99370000 Z=0.25000000
      -3: X=0.59050000 Y=0.59680000 Z=0.25000000
      -3: X=0.40950000 Y=0.40320000 Z=0.75000000
As         NPT=  781  R0=.000050000 RMT= 1.75        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.14230000 Y=0.60760000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -4: X=0.85770000 Y=0.39240000 Z=0.75000000
      -4: X=0.53470000 Y=0.14230000 Z=0.75000000
      -4: X=0.46530000 Y=0.85770000 Z=0.25000000
      -4: X=0.39240000 Y=0.53470000 Z=0.25000000
      -4: X=0.60760000 Y=0.46530000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.58        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=0.09140000 Y=0.37030000 Z=0.05680000
          MULT=12          ISPLIT= 8
      -5: X=0.90860000 Y=0.62970000 Z=0.94320000
      -5: X=0.72110000 Y=0.09140000 Z=0.55680000
      -5: X=0.27890000 Y=0.90860000 Z=0.44320000
      -5: X=0.62970000 Y=0.72110000 Z=0.05680000
      -5: X=0.37030000 Y=0.27890000 Z=0.94320000
      -5: X=0.90860000 Y=0.62970000 Z=0.55680000
      -5: X=0.09140000 Y=0.37030000 Z=0.44320000
      -5: X=0.27890000 Y=0.90860000 Z=0.05680000
      -5: X=0.72110000 Y=0.09140000 Z=0.94320000
      -5: X=0.37030000 Y=0.27890000 Z=0.55680000
      -5: X=0.62970000 Y=0.72110000 Z=0.44320000
O          NPT=  781  R0=.000100000 RMT= 1.58        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=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -6: X=0.00000000 Y=0.00000000 Z=0.50000000
Cl         NPT=  781  R0=.000100000 RMT= 2.50000     Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000