H   LATTICE,NONEQUIV.ATOMS   4  176 P63/m                                      
MODE OF CALC=RELA unit=bohr                                                    
 15.387662 15.387662 14.448090 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.04400000
          MULT= 4          ISPLIT= 4
      -1: X=0.66666667 Y=0.33333333 Z=0.95600000
      -1: X=0.66666666 Y=0.33333333 Z=0.54400000
      -1: X=0.33333334 Y=0.66666667 Z=0.45600000
Sc         NPT=  781  R0=.000050000 RMT= 1.99        Z:  21.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.30016000 Y=0.03220000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -2: X=0.69984000 Y=0.96780000 Z=0.75000000
      -2: X=0.26796000 Y=0.30016000 Z=0.75000000
      -2: X=0.73204000 Y=0.69984000 Z=0.25000000
      -2: X=0.96780000 Y=0.26796000 Z=0.25000000
      -2: X=0.03220000 Y=0.73204000 Z=0.75000000
Se         NPT=  781  R0=.000050000 RMT= 1.64        Z:  34.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.12720000 Y=0.50400000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.87280000 Y=0.49600000 Z=0.75000000
      -3: X=0.62320000 Y=0.12720000 Z=0.75000000
      -3: X=0.37680000 Y=0.87280000 Z=0.25000000
      -3: X=0.49600000 Y=0.62320000 Z=0.25000000
      -3: X=0.50400000 Y=0.37680000 Z=0.75000000
O          NPT=  781  R0=.000100000 RMT= 1.48        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  -4: X=0.41850000 Y=0.16640000 Z=0.07960000
          MULT=12          ISPLIT= 8
      -4: X=0.58150000 Y=0.83360000 Z=0.92040000
      -4: X=0.25210000 Y=0.41850000 Z=0.57960000
      -4: X=0.74790000 Y=0.58150000 Z=0.42040000
      -4: X=0.83360000 Y=0.25210000 Z=0.07960000
      -4: X=0.16640000 Y=0.74790000 Z=0.92040000
      -4: X=0.58150000 Y=0.83360000 Z=0.57960000
      -4: X=0.41850000 Y=0.16640000 Z=0.42040000
      -4: X=0.74790000 Y=0.58150000 Z=0.07960000
      -4: X=0.25210000 Y=0.41850000 Z=0.92040000
      -4: X=0.16640000 Y=0.74790000 Z=0.57960000
      -4: X=0.83360000 Y=0.25210000 Z=0.42040000
O          NPT=  781  R0=.000100000 RMT= 1.48        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000