R   LATTICE,NONEQUIV.ATOMS   5  160 R3m                                        
MODE OF CALC=RELA unit=bohr                                                    
 11.412055 11.412055 11.064344 90.000000 90.000000120.000000                   
ATOM  -1: X=0.51019000 Y=0.51019000 Z=0.51019000
          MULT= 1          ISPLIT= 4
C          NPT=  781  R0=.000100000 RMT= 1.32        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.29134000 Y=0.68906000 Z=0.29134000
          MULT= 3          ISPLIT= 8
      -2: X=0.68906000 Y=0.29134000 Z=0.29134000
      -2: X=0.29134000 Y=0.29134000 Z=0.68906000
O          NPT=  781  R0=.000100000 RMT= 1.46        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.76449000 Y=0.76449000 Z=0.76449000
          MULT= 1          ISPLIT= 4
O          NPT=  781  R0=.000100000 RMT= 1.46        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.78601000 Y=0.27704000 Z=0.78601000
          MULT= 3          ISPLIT= 8
      -4: X=0.27704000 Y=0.78601000 Z=0.78601000
      -4: X=0.78601000 Y=0.78601000 Z=0.27704000
Li         NPT=  781  R0=.000100000 RMT= 1.65        Z:   3.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -5: X=0.18787000 Y=0.18787000 Z=0.18787000
          MULT= 1          ISPLIT= 4
Li         NPT=  781  R0=.000100000 RMT= 1.65        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000