R   LATTICE,NONEQUIV.ATOMS   2  155 R32                                        
MODE OF CALC=RELA unit=bohr                                                    
 10.733835 10.733835 13.191045 90.000000 90.000000120.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 4
Sc         NPT=  781  R0=.000050000 RMT= 1.94        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=0.98700000 Y=0.01300000 Z=0.50000000
          MULT= 3          ISPLIT= 8
      -2: X=0.01300000 Y=0.50000000 Z=0.98700000
      -2: X=0.50000000 Y=0.98700000 Z=0.01300000
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