H   LATTICE,NONEQUIV.ATOMS   2  176 P63/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 12.151695 12.151695 12.938199 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.25000000
          MULT= 2          ISPLIT= 4
      -1: X=0.66666667 Y=0.33333333 Z=0.75000000
B          NPT=  781  R0=.000100000 RMT= 1.56        Z:   5.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.04715000 Y=0.36314000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.95285000 Y=0.63686000 Z=0.75000000
      -2: X=0.68401000 Y=0.04715000 Z=0.75000000
      -2: X=0.31599000 Y=0.95285000 Z=0.25000000
      -2: X=0.63686000 Y=0.68401000 Z=0.25000000
      -2: X=0.36314000 Y=0.31599000 Z=0.75000000
Br         NPT=  781  R0=.000050000 RMT= 2.01        Z:  35.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000