R   LATTICE,NONEQUIV.ATOMS   5  160 R3m                                        
MODE OF CALC=RELA unit=bohr                                                    
  7.653391  7.653391 54.367419 90.000000 90.000000120.000000                   
ATOM  -1: X=0.75800000 Y=0.75800000 Z=0.75800000
          MULT= 1          ISPLIT= 4
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.28200000 Y=0.28200000 Z=0.28200000
          MULT= 1          ISPLIT= 4
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
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
Se         NPT=  781  R0=.000050000 RMT= 2.45        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.47500000 Y=0.47500000 Z=0.47500000
          MULT= 1          ISPLIT= 4
Se         NPT=  781  R0=.000050000 RMT= 2.45        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.18200000 Y=0.18200000 Z=0.18200000
          MULT= 1          ISPLIT= 4
Se         NPT=  781  R0=.000050000 RMT= 2.45        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000