R   LATTICE,NONEQUIV.ATOMS   3  166 R-3m                                       
MODE OF CALC=RELA unit=bohr                                                    
 24.804546 24.804546 16.376363 90.000000 90.000000120.000000                   
ATOM  -1: X=0.92521000 Y=0.67233000 Z=0.92521000
          MULT= 6          ISPLIT= 8
      -1: X=0.07479000 Y=0.32767000 Z=0.07479000
      -1: X=0.67233000 Y=0.92521000 Z=0.92521000
      -1: X=0.32767000 Y=0.07479000 Z=0.07479000
      -1: X=0.92521000 Y=0.92521000 Z=0.67233000
      -1: X=0.07479000 Y=0.07479000 Z=0.32767000
Pt         NPT=  781  R0=.000005000 RMT= 2.39        Z:  78.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.60530000 Y=0.85519000 Z=0.60530000
          MULT= 6          ISPLIT= 8
      -2: X=0.39470000 Y=0.14481000 Z=0.39470000
      -2: X=0.85519000 Y=0.60530000 Z=0.60530000
      -2: X=0.14481000 Y=0.39470000 Z=0.39470000
      -2: X=0.60530000 Y=0.60530000 Z=0.85519000
      -2: X=0.39470000 Y=0.39470000 Z=0.14481000
Cl         NPT=  781  R0=.000100000 RMT= 1.95        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000-0.5000000 0.8660254
                     0.0000000-0.8660254-0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.24740000 Y=0.75260000 Z=0.00000000
          MULT= 6          ISPLIT= 8
      -3: X=0.75260000 Y=0.24740000 Z=0.00000000
      -3: X=0.75260000 Y=0.00000000 Z=0.24740000
      -3: X=0.24740000 Y=0.00000000 Z=0.75260000
      -3: X=0.00000000 Y=0.24740000 Z=0.75260000
      -3: X=0.00000000 Y=0.75260000 Z=0.24740000
Cl         NPT=  781  R0=.000100000 RMT= 1.95        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000