R   LATTICE,NONEQUIV.ATOMS   4  160 R3m                                        
MODE OF CALC=RELA unit=bohr                                                    
  6.889753  6.889753 28.800372 90.000000 90.000000120.000000                   
ATOM  -1: X=0.57200000 Y=0.57200000 Z=0.57200000
          MULT= 1          ISPLIT= 4
N          NPT=  781  R0=.000100000 RMT= 1.03        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.50000000 Y=0.50000000 Z=0.50000000
          MULT= 1          ISPLIT= 4
N          NPT=  781  R0=.000100000 RMT= 1.03        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.41700000 Y=0.41700000 Z=0.41700000
          MULT= 1          ISPLIT= 4
N          NPT=  781  R0=.000100000 RMT= 1.03        Z:   7.00000              
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= 4
Na         NPT=  781  R0=.000100000 RMT= 2.37        Z:  11.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000