P   LATTICE,NONEQUIV.ATOMS   4  135 P42/mbc                                    
MODE OF CALC=RELA unit=bohr                                                    
 16.650377 16.650377 12.402273 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.50000000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.00000000 Y=0.50000000 Z=0.75000000
      -1: X=0.50000000 Y=0.00000000 Z=0.75000000
      -1: X=0.50000000 Y=0.00000000 Z=0.25000000
Pb         NPT=  781  R0=.000005000 RMT= 2.21        Z:  82.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.16100000 Y=0.14100000 Z=0.00000000
          MULT= 8          ISPLIT= 8
      -2: X=0.83900000 Y=0.85900000 Z=0.00000000
      -2: X=0.85900000 Y=0.16100000 Z=0.50000000
      -2: X=0.14100000 Y=0.83900000 Z=0.50000000
      -2: X=0.33900000 Y=0.64100000 Z=0.00000000
      -2: X=0.66100000 Y=0.35900000 Z=0.00000000
      -2: X=0.35900000 Y=0.33900000 Z=0.50000000
      -2: X=0.64100000 Y=0.66100000 Z=0.50000000
Pb         NPT=  781  R0=.000005000 RMT= 2.21        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=0.17200000 Y=0.67200000 Z=0.25000000
          MULT= 8          ISPLIT= 8
      -3: X=0.82800000 Y=0.32800000 Z=0.75000000
      -3: X=0.32800000 Y=0.17200000 Z=0.75000000
      -3: X=0.67200000 Y=0.82800000 Z=0.25000000
      -3: X=0.32800000 Y=0.17200000 Z=0.25000000
      -3: X=0.67200000 Y=0.82800000 Z=0.75000000
      -3: X=0.82800000 Y=0.32800000 Z=0.25000000
      -3: X=0.17200000 Y=0.67200000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.81        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.7071068 0.7071068
                     0.0000000-0.7071068 0.7071068
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.13500000 Y=0.40500000 Z=0.00000000
          MULT= 8          ISPLIT= 8
      -4: X=0.86500000 Y=0.59500000 Z=0.00000000
      -4: X=0.59500000 Y=0.13500000 Z=0.50000000
      -4: X=0.40500000 Y=0.86500000 Z=0.50000000
      -4: X=0.36500000 Y=0.90500000 Z=0.00000000
      -4: X=0.63500000 Y=0.09500000 Z=0.00000000
      -4: X=0.09500000 Y=0.36500000 Z=0.50000000
      -4: X=0.90500000 Y=0.63500000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.81        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000