B   LATTICE,NONEQUIV.ATOMS   2  141 I41/amd 
MODE OF CALC=RELA unit=bohr
  8.588805  8.588805 21.331229 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.25000000 Z=0.37500000
          MULT= 2          ISPLIT=15
      -1: X=0.00000000 Y=0.75000000 Z=0.62500000
Pb         NPT=  781  R0=.000005000 RMT=   2.00000   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=0.00000000 Y=0.75000000 Z=0.12500000
          MULT= 2          ISPLIT=15
      -2: X=0.00000000 Y=0.25000000 Z=0.87500000
Th         NPT=  781  R0=.000005000 RMT=   2.00000   Z:  90.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000