P   LATTICE,NONEQUIV.ATOMS   4  136 P42/mnm                                    
MODE OF CALC=RELA unit=bohr                                                    
  8.917429  8.917429 17.386047 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -1: X=0.50000000 Y=0.50000000 Z=0.50000000
Mg         NPT=  781  R0=.000100000 RMT= 1.93        Z:  12.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.00000000 Y=0.00000000 Z=0.33190000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.00000000 Z=0.66810000
      -2: X=0.50000000 Y=0.50000000 Z=0.83190000
      -2: X=0.50000000 Y=0.50000000 Z=0.16810000
Ta         NPT=  781  R0=.000005000 RMT= 1.99        Z:  73.00000              
LOCAL ROT MATRIX:    0.7071068 0.7071068 0.0000000
                    -0.7071068 0.7071068 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.30800000 Y=0.30800000 Z=0.00000000
          MULT= 4          ISPLIT= 8
      -3: X=0.69200000 Y=0.69200000 Z=0.00000000
      -3: X=0.19200000 Y=0.80800000 Z=0.50000000
      -3: X=0.80800000 Y=0.19200000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.71        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068 0.7071068
                     0.0000000 0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -4: X=0.29700000 Y=0.29700000 Z=0.32300000
          MULT= 8          ISPLIT= 8
      -4: X=0.70300000 Y=0.70300000 Z=0.67700000
      -4: X=0.20300000 Y=0.79700000 Z=0.82300000
      -4: X=0.79700000 Y=0.20300000 Z=0.17700000
      -4: X=0.70300000 Y=0.70300000 Z=0.32300000
      -4: X=0.29700000 Y=0.29700000 Z=0.67700000
      -4: X=0.79700000 Y=0.20300000 Z=0.82300000
      -4: X=0.20300000 Y=0.79700000 Z=0.17700000
O          NPT=  781  R0=.000100000 RMT= 1.71        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000