H   LATTICE,NONEQUIV.ATOMS   4  189 P-62m   
MODE OF CALC=RELA unit=bohr
 13.729427 13.729427  7.900189 90.000000 90.000000120.000000
ATOM  -1: X=0.25000000 Y=0.00000000 Z=0.50000000
          MULT= 3          ISPLIT=15
      -1: X=0.75000000 Y=0.75000000 Z=0.50000000
      -1: X=0.00000000 Y=0.25000000 Z=0.50000000
Al         NPT=  781  R0=.000100000 RMT=   2.00000   Z:  13.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.59000000 Y=0.00000000 Z=0.00000000
          MULT= 3          ISPLIT=15
      -2: X=0.41000000 Y=0.41000000 Z=0.00000000
      -2: X=0.00000000 Y=0.59000000 Z=0.00000000
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
ATOM  -3: X=0.33333333 Y=0.66666667 Z=0.50000000
          MULT= 2          ISPLIT=15
      -3: X=0.66666667 Y=0.33333333 Z=0.50000000
Pd         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  46.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT=15
Pd         NPT=  781  R0=.000010000 RMT=   2.00000   Z:  46.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000