H   LATTICE,NONEQUIV.ATOMS   3  176 P63/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 12.056453 12.056453  4.525894 90.000000 90.000000120.000000                   
ATOM  -1: X=0.22730000 Y=0.40540000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -1: X=0.77270000 Y=0.59460000 Z=0.75000000
      -1: X=0.82190000 Y=0.22730000 Z=0.75000000
      -1: X=0.17810000 Y=0.77270000 Z=0.25000000
      -1: X=0.59460000 Y=0.82190000 Z=0.25000000
      -1: X=0.40540000 Y=0.17810000 Z=0.75000000
C          NPT=  781  R0=.000100000 RMT= 1.32        Z:   6.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -2: X=0.66666667 Y=0.33333333 Z=0.75000000
N          NPT=  781  R0=.000100000 RMT= 1.39        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.33020000 Y=0.03280000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.66980000 Y=0.96720000 Z=0.75000000
      -3: X=0.29740000 Y=0.33020000 Z=0.75000000
      -3: X=0.70260000 Y=0.66980000 Z=0.25000000
      -3: X=0.96720000 Y=0.29740000 Z=0.25000000
      -3: X=0.03280000 Y=0.70260000 Z=0.75000000
N          NPT=  781  R0=.000100000 RMT= 1.39        Z:   7.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000