H   LATTICE,NONEQUIV.ATOMS   4  182 P6322                                      
MODE OF CALC=RELA unit=bohr                                                    
 10.255544 10.255544 23.349456 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
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=0.75000000
          MULT= 2          ISPLIT= 4
      -2: X=0.66666666 Y=0.33333333 Z=0.25000000
I          NPT=  781  R0=.000010000 RMT= 2.12        Z:  53.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -3: X=0.66666666 Y=0.33333333 Z=0.75000000
Pb         NPT=  781  R0=.000005000 RMT= 1.88        Z:  82.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                    -1.0000000 0.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.03700000 Y=0.43000000 Z=0.16400000
          MULT=12          ISPLIT= 8
      -4: X=0.60700000 Y=0.03700000 Z=0.66400000
      -4: X=0.57000000 Y=0.96300000 Z=0.33600000
      -4: X=0.57000000 Y=0.60700000 Z=0.16400000
      -4: X=0.60700000 Y=0.57000000 Z=0.83600000
      -4: X=0.96300000 Y=0.57000000 Z=0.66400000
      -4: X=0.03700000 Y=0.60700000 Z=0.33600000
      -4: X=0.39300000 Y=0.96300000 Z=0.16400000
      -4: X=0.43000000 Y=0.03700000 Z=0.83600000
      -4: X=0.43000000 Y=0.39300000 Z=0.66400000
      -4: X=0.39300000 Y=0.43000000 Z=0.33600000
      -4: X=0.96300000 Y=0.39300000 Z=0.83600000
O          NPT=  781  R0=.000100000 RMT= 1.54        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000