R   LATTICE,NONEQUIV.ATOMS   3  148 R-3                                        
MODE OF CALC=RELA unit=bohr                                                    
  9.085804  9.085804 26.853010 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33860000 Y=0.33860000 Z=0.33860000
          MULT= 2          ISPLIT= 4
      -1: X=0.66140000 Y=0.66140000 Z=0.66140000
As         NPT=  781  R0=.000050000 RMT= 1.79        Z:  33.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.13900000 Y=0.13900000 Z=0.13900000
          MULT= 2          ISPLIT= 4
      -2: X=0.86100000 Y=0.86100000 Z=0.86100000
Li         NPT=  781  R0=.000100000 RMT= 1.72        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  -3: X=0.45230000 Y=0.70129000 Z=0.06430000
          MULT= 6          ISPLIT= 8
      -3: X=0.54770000 Y=0.29871000 Z=0.93570000
      -3: X=0.70129000 Y=0.06430000 Z=0.45230000
      -3: X=0.29871000 Y=0.93570000 Z=0.54770000
      -3: X=0.06430000 Y=0.45230000 Z=0.70129000
      -3: X=0.93570000 Y=0.54770000 Z=0.29871000
O          NPT=  781  R0=.000100000 RMT= 1.62        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000