B   LATTICE,NONEQUIV.ATOMS   3  141 I41/amd 
MODE OF CALC=RELA unit=bohr
 13.681428 13.681428 12.361832 90.000000 90.000000 90.000000
ATOM  -1: X=0.00000000 Y=0.75000000 Z=0.12500000
          MULT= 2          ISPLIT=15
      -1: 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
ATOM  -2: X=0.00000000 Y=0.25000000 Z=0.37500000
          MULT= 2          ISPLIT=15
      -2: X=0.00000000 Y=0.75000000 Z=0.62500000
Ge         NPT=  781  R0=.000050000 RMT=   2.00000   Z:  32.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.06920000 Z=0.19790000
          MULT= 8          ISPLIT=15
      -3: X=0.00000000 Y=0.93080000 Z=0.80210000
      -3: X=0.18080000 Y=0.75000000 Z=0.44790000
      -3: X=0.31920000 Y=0.75000000 Z=0.05210000
      -3: X=0.00000000 Y=0.43080000 Z=0.19790000
      -3: X=0.00000000 Y=0.56920000 Z=0.80210000
      -3: X=0.31920000 Y=0.25000000 Z=0.94790000
      -3: X=0.18080000 Y=0.25000000 Z=0.55210000
O          NPT=  781  R0=.000100000 RMT=   2.00000   Z:   8.00000
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000