R   LATTICE,NONEQUIV.ATOMS   1  148 R-3                                        
MODE OF CALC=RELA unit=bohr                                                    
 20.598015 20.598015  8.069126 90.000000 90.000000120.000000                   
ATOM  -1: X=0.14900000 Y=0.25400000 Z=0.91500000
          MULT= 6          ISPLIT= 8
      -1: X=0.85100000 Y=0.74600000 Z=0.08500000
      -1: X=0.25400000 Y=0.91500000 Z=0.14900000
      -1: X=0.74600000 Y=0.08500000 Z=0.85100000
      -1: X=0.91500000 Y=0.14900000 Z=0.25400000
      -1: X=0.08500000 Y=0.85100000 Z=0.74600000
S          NPT=  781  R0=.000100000 RMT= 1.97        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000