H   LATTICE,NONEQUIV.ATOMS   7  186 P63mc                                      
MODE OF CALC=RELA unit=bohr                                                    
 10.918838 10.918838 18.715848 90.000000 90.000000120.000000                   
ATOM  -1: X=0.33333333 Y=0.66666667 Z=0.55290000
          MULT= 2          ISPLIT= 4
      -1: X=0.66666666 Y=0.33333333 Z=0.05290000
Mg         NPT=  781  R0=.000100000 RMT= 1.83        Z:  12.00000              
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=0.98860000
          MULT= 2          ISPLIT= 4
      -2: X=0.66666666 Y=0.33333333 Z=0.48860000
Mg         NPT=  781  R0=.000100000 RMT= 1.83        Z:  12.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.14623000 Y=0.85377000 Z=0.25000000
          MULT= 6          ISPLIT= 8
      -3: X=0.29246000 Y=0.14623000 Z=0.75000000
      -3: X=0.85377000 Y=0.14623000 Z=0.75000000
      -3: X=0.14623000 Y=0.29246000 Z=0.25000000
      -3: X=0.70754000 Y=0.85377000 Z=0.25000000
      -3: X=0.85377000 Y=0.70754000 Z=0.75000000
Mo         NPT=  781  R0=.000010000 RMT= 1.92        Z:  42.00000              
LOCAL ROT MATRIX:    0.0000000 0.5000000 0.8660254
                     0.0000000-0.8660254 0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.00000000 Z=0.10800000
          MULT= 2          ISPLIT= 4
      -4: X=0.00000000 Y=0.00000000 Z=0.60800000
O          NPT=  781  R0=.000100000 RMT= 1.74        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=0.33333333 Y=0.66666667 Z=0.35600000
          MULT= 2          ISPLIT= 4
      -5: X=0.66666666 Y=0.33333333 Z=0.85600000
O          NPT=  781  R0=.000100000 RMT= 1.74        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  -6: X=0.48730000 Y=0.51270000 Z=0.13350000
          MULT= 6          ISPLIT= 8
      -6: X=0.97460000 Y=0.48730000 Z=0.63350000
      -6: X=0.51270000 Y=0.48730000 Z=0.63350000
      -6: X=0.48730000 Y=0.97460000 Z=0.13350000
      -6: X=0.02540000 Y=0.51270000 Z=0.13350000
      -6: X=0.51270000 Y=0.02540000 Z=0.63350000
O          NPT=  781  R0=.000100000 RMT= 1.74        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.5000000 0.8660254
                     0.0000000-0.8660254 0.5000000
                     1.0000000 0.0000000 0.0000000
ATOM  -7: X=0.83270000 Y=0.16730000 Z=0.36540000
          MULT= 6          ISPLIT= 8
      -7: X=0.66540000 Y=0.83270000 Z=0.86540000
      -7: X=0.16730000 Y=0.83270000 Z=0.86540000
      -7: X=0.83270000 Y=0.66540000 Z=0.36540000
      -7: X=0.33460000 Y=0.16730000 Z=0.36540000
      -7: X=0.16730000 Y=0.33460000 Z=0.86540000
O          NPT=  781  R0=.000100000 RMT= 1.74        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.5000000 0.8660254
                     0.0000000-0.8660254 0.5000000
                     1.0000000 0.0000000 0.0000000