R   LATTICE,NONEQUIV.ATOMS   2  167 R-3c                                       
MODE OF CALC=RELA unit=bohr                                                    
 10.732511 10.732511 26.146061 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
Sc         NPT=  781  R0=.000050000 RMT= 1.93        Z:  21.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.72782000 Y=0.77218000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.27218000 Y=0.22782000 Z=0.75000000
      -2: X=0.77218000 Y=0.25000000 Z=0.72782000
      -2: X=0.22782000 Y=0.75000000 Z=0.27218000
      -2: X=0.25000000 Y=0.72782000 Z=0.77218000
      -2: X=0.75000000 Y=0.27218000 Z=0.22782000
F          NPT=  781  R0=.000100000 RMT= 1.84        Z:   9.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000