H   LATTICE,NONEQUIV.ATOMS   3  176 P63/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 16.780768 16.780768  8.484870 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
In         NPT=  781  R0=.000010000 RMT= 2.50000     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  -2: X=0.17000000 Y=0.14900000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.83000000 Y=0.85100000 Z=0.75000000
      -2: X=0.02100000 Y=0.17000000 Z=0.75000000
      -2: X=0.97900000 Y=0.83000000 Z=0.25000000
      -2: X=0.85100000 Y=0.02100000 Z=0.25000000
      -2: X=0.14900000 Y=0.97900000 Z=0.75000000
Mo         NPT=  781  R0=.000010000 RMT= 2.32        Z:  42.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.04600000 Y=0.35700000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.95400000 Y=0.64300000 Z=0.75000000
      -3: X=0.68900000 Y=0.04600000 Z=0.75000000
      -3: X=0.31100000 Y=0.95400000 Z=0.25000000
      -3: X=0.64300000 Y=0.68900000 Z=0.25000000
      -3: X=0.35700000 Y=0.31100000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 2.42        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000