H   LATTICE,NONEQUIV.ATOMS   5  186 P63mc                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.391862 16.391862 12.576883 90.000000 90.000000120.000000                   
ATOM  -1: X=0.85660000 Y=0.14340000 Z=0.02890000
          MULT= 6          ISPLIT= 8
      -1: X=0.71320000 Y=0.85660000 Z=0.52890000
      -1: X=0.14340000 Y=0.85660000 Z=0.52890000
      -1: X=0.85660000 Y=0.71320000 Z=0.02890000
      -1: X=0.28680000 Y=0.14340000 Z=0.02890000
      -1: X=0.14340000 Y=0.28680000 Z=0.52890000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 0.5000000 0.8660254
                     0.0000000-0.8660254 0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.53620000 Y=0.46380000 Z=0.35780000
          MULT= 6          ISPLIT= 8
      -2: X=0.07240000 Y=0.53620000 Z=0.85780000
      -2: X=0.46380000 Y=0.53620000 Z=0.85780000
      -2: X=0.53620000 Y=0.07240000 Z=0.35780000
      -2: X=0.92760000 Y=0.46380000 Z=0.35780000
      -2: X=0.46380000 Y=0.92760000 Z=0.85780000
K          NPT=  781  R0=.000050000 RMT= 2.50000     Z:  19.00000              
LOCAL ROT MATRIX:    0.0000000 0.5000000 0.8660254
                     0.0000000-0.8660254 0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -3: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -3: X=0.66666666 Y=0.33333333 Z=0.75000000
Cd         NPT=  781  R0=.000010000 RMT= 2.21        Z:  48.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.33333333 Y=0.66666667 Z=0.57930000
          MULT= 2          ISPLIT= 4
      -4: X=0.66666666 Y=0.33333333 Z=0.07930000
O          NPT=  781  R0=.000100000 RMT= 1.90        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.19270000 Y=0.80730000 Z=0.13940000
          MULT= 6          ISPLIT= 8
      -5: X=0.38540000 Y=0.19270000 Z=0.63940000
      -5: X=0.80730000 Y=0.19270000 Z=0.63940000
      -5: X=0.19270000 Y=0.38540000 Z=0.13940000
      -5: X=0.61460000 Y=0.80730000 Z=0.13940000
      -5: X=0.80730000 Y=0.61460000 Z=0.63940000
O          NPT=  781  R0=.000100000 RMT= 1.90        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.5000000 0.8660254
                     0.0000000-0.8660254 0.5000000
                     1.0000000 0.0000000 0.0000000