CuFeO2-r3m                                                  
R   LATTICE,NONEQUIV.ATOMS:  3166_R-3m                      
MODE OF CALC=RELA unit=bohr
  5.721738  5.721738 32.302238 90.000000 90.000000120.000000
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
Cu         NPT=  781  R0=0.00005000 RMT=    2.0000   Z: 29.0
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.50000000 Y=0.50000000 Z=0.50000000
          MULT= 1          ISPLIT= 8
Fe         NPT=  781  R0=0.00005000 RMT=    2.0000   Z: 26.0
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.11111000 Y=0.11111000 Z=0.11111000
          MULT= 2          ISPLIT= 8
ATOM  -3:X= 0.88889000 Y=0.88889000 Z=0.88889000
O          NPT=  781  R0=0.00010000 RMT=    2.0000   Z:  8.0
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
   0      NUMBER OF SYMMETRY OPERATIONS