R   LATTICE,NONEQUIV.ATOMS   3  161 R3c                                        
MODE OF CALC=RELA unit=bohr                                                    
 11.111400 11.111400 29.278091 90.000000 90.000000120.000000                   
ATOM  -1: X=0.29200000 Y=0.29200000 Z=0.29200000
          MULT= 2          ISPLIT= 4
      -1: X=0.79200000 Y=0.79200000 Z=0.79200000
Na         NPT=  781  R0=.000100000 RMT= 2.11        Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00200000 Y=0.00200000 Z=0.00200000
          MULT= 2          ISPLIT= 4
      -2: X=0.50200000 Y=0.50200000 Z=0.50200000
Cd         NPT=  781  R0=.000010000 RMT= 2.24        Z:  48.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.10900000 Y=0.39099000 Z=0.70200000
          MULT= 6          ISPLIT= 8
      -3: X=0.39099000 Y=0.70200000 Z=0.10900000
      -3: X=0.60900000 Y=0.20200000 Z=0.89099000
      -3: X=0.70200000 Y=0.10900000 Z=0.39099000
      -3: X=0.20200000 Y=0.89099000 Z=0.60900000
      -3: X=0.89099000 Y=0.60900000 Z=0.20200000
F          NPT=  781  R0=.000100000 RMT= 2.03        Z:   9.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000