R   LATTICE,NONEQUIV.ATOMS   3  161 R3c                                        
MODE OF CALC=RELA unit=bohr                                                    
  9.852087  9.852087 26.020393 90.000000 90.000000120.000000                   
ATOM  -1: X=0.22350000 Y=0.22350000 Z=0.22350000
          MULT= 2          ISPLIT= 4
      -1: X=0.72350000 Y=0.72350000 Z=0.72350000
Li         NPT=  781  R0=.000100000 RMT= 1.73        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -2: X=0.50000000 Y=0.50000000 Z=0.50000000
Ta         NPT=  781  R0=.000005000 RMT= 1.98        Z:  73.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.13410000 Y=0.36081000 Z=0.75460000
          MULT= 6          ISPLIT= 8
      -3: X=0.36081000 Y=0.75460000 Z=0.13410000
      -3: X=0.63410000 Y=0.25460000 Z=0.86081000
      -3: X=0.75460000 Y=0.13410000 Z=0.36081000
      -3: X=0.25460000 Y=0.86081000 Z=0.63410000
      -3: X=0.86081000 Y=0.63410000 Z=0.25460000
O          NPT=  781  R0=.000100000 RMT= 1.71        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000