R   LATTICE,NONEQUIV.ATOMS   2  166 R-3m                                       
MODE OF CALC=RELA unit=bohr                                                    
 14.076571 14.076571 18.679942 90.000000 90.000000120.000000                   
ATOM  -1: X=0.70370000 Y=0.25860000 Z=0.70370000
          MULT= 6          ISPLIT= 8
      -1: X=0.29630000 Y=0.74140000 Z=0.29630000
      -1: X=0.25860000 Y=0.70370000 Z=0.70370000
      -1: X=0.74140000 Y=0.29630000 Z=0.29630000
      -1: X=0.70370000 Y=0.70370000 Z=0.25860000
      -1: X=0.29630000 Y=0.29630000 Z=0.74140000
P          NPT=  781  R0=.000100000 RMT= 2.07        Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.22450000 Y=0.22450000 Z=0.22450000
          MULT= 2          ISPLIT= 4
      -2: X=0.77550000 Y=0.77550000 Z=0.77550000
In         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000