R   LATTICE,NONEQUIV.ATOMS   4  167 R-3c                                       
MODE OF CALC=RELA unit=bohr                                                    
 23.324890 23.324890 33.695703 90.000000 90.000000120.000000                   
ATOM  -1: X=0.91240000 Y=0.58760000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -1: X=0.08760000 Y=0.41240000 Z=0.75000000
      -1: X=0.58760000 Y=0.25000000 Z=0.91240000
      -1: X=0.41240000 Y=0.75000000 Z=0.08760000
      -1: X=0.25000000 Y=0.91240000 Z=0.58760000
      -1: X=0.75000000 Y=0.08760000 Z=0.41240000
In         NPT=  781  R0=.000010000 RMT= 2.42        Z:  49.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.14800000 Y=0.14800000 Z=0.14800000
          MULT= 4          ISPLIT= 4
      -2: X=0.85200000 Y=0.85200000 Z=0.85200000
      -2: X=0.64800000 Y=0.64800000 Z=0.64800000
      -2: X=0.35200000 Y=0.35200000 Z=0.35200000
In         NPT=  781  R0=.000010000 RMT= 2.42        Z:  49.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.40570000 Y=0.09430000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.59430000 Y=0.90570000 Z=0.75000000
      -3: X=0.09430000 Y=0.25000000 Z=0.40570000
      -3: X=0.90570000 Y=0.75000000 Z=0.59430000
      -3: X=0.25000000 Y=0.40570000 Z=0.09430000
      -3: X=0.75000000 Y=0.59430000 Z=0.90570000
Cl         NPT=  781  R0=.000100000 RMT= 2.08        Z:  17.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.26620000 Y=0.08361000 Z=0.91770000
          MULT=12          ISPLIT= 8
      -4: X=0.73380000 Y=0.91639000 Z=0.08230000
      -4: X=0.08361000 Y=0.91770000 Z=0.26620000
      -4: X=0.91639000 Y=0.08230000 Z=0.73380000
      -4: X=0.76620000 Y=0.41770000 Z=0.58361000
      -4: X=0.23380000 Y=0.58230000 Z=0.41639000
      -4: X=0.91770000 Y=0.26620000 Z=0.08361000
      -4: X=0.08230000 Y=0.73380000 Z=0.91639000
      -4: X=0.41770000 Y=0.58361000 Z=0.76620000
      -4: X=0.58230000 Y=0.41639000 Z=0.23380000
      -4: X=0.58361000 Y=0.76620000 Z=0.41770000
      -4: X=0.41639000 Y=0.23380000 Z=0.58230000
Cl         NPT=  781  R0=.000100000 RMT= 2.08        Z:  17.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000