R   LATTICE,NONEQUIV.ATOMS   4  167 R-3c                                       
MODE OF CALC=RELA unit=bohr                                                    
 18.524796 18.524796 21.164930 90.000000 90.000000120.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 4
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
Nb         NPT=  781  R0=.000010000 RMT= 1.97        Z:  41.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.60310000 Y=0.89690000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.39690000 Y=0.10310000 Z=0.75000000
      -2: X=0.89690000 Y=0.25000000 Z=0.60310000
      -2: X=0.10310000 Y=0.75000000 Z=0.39690000
      -2: X=0.25000000 Y=0.60310000 Z=0.89690000
      -2: X=0.75000000 Y=0.39690000 Z=0.10310000
Sr         NPT=  781  R0=.000010000 RMT= 2.33        Z:  38.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.27980000 Y=0.95160000 Z=0.08000000
          MULT=12          ISPLIT= 8
      -3: X=0.72020000 Y=0.04840000 Z=0.92000000
      -3: X=0.95160000 Y=0.08000000 Z=0.27980000
      -3: X=0.04840000 Y=0.92000000 Z=0.72020000
      -3: X=0.77980000 Y=0.58000000 Z=0.45160000
      -3: X=0.22020000 Y=0.42000000 Z=0.54840000
      -3: X=0.08000000 Y=0.27980000 Z=0.95160000
      -3: X=0.92000000 Y=0.72020000 Z=0.04840000
      -3: X=0.58000000 Y=0.45160000 Z=0.77980000
      -3: X=0.42000000 Y=0.54840000 Z=0.22020000
      -3: X=0.45160000 Y=0.77980000 Z=0.58000000
      -3: X=0.54840000 Y=0.22020000 Z=0.42000000
O          NPT=  781  R0=.000100000 RMT= 1.78        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=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -4: X=0.75000000 Y=0.75000000 Z=0.75000000
Li         NPT=  781  R0=.000100000 RMT= 1.95        Z:   3.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000