R   LATTICE,NONEQUIV.ATOMS   4  166 R-3m                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.954743 10.954743 52.390766 90.000000 90.000000120.000000                   
ATOM  -1: X=0.20859000 Y=0.20859000 Z=0.20859000
          MULT= 2          ISPLIT= 4
      -1: X=0.79141000 Y=0.79141000 Z=0.79141000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.39171000 Y=0.39171000 Z=0.39171000
          MULT= 2          ISPLIT= 4
      -2: X=0.60829000 Y=0.60829000 Z=0.60829000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
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=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 4
Cd         NPT=  781  R0=.000010000 RMT= 2.38        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  -4: X=0.08920000 Y=0.08920000 Z=0.08920000
          MULT= 2          ISPLIT= 4
      -4: X=0.91080000 Y=0.91080000 Z=0.91080000
As         NPT=  781  R0=.000050000 RMT= 2.26        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000