P   LATTICE,NONEQUIV.ATOMS   6  198 P213                                       
MODE OF CALC=RELA unit=bohr                                                    
 15.507093 15.507093 15.507093 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 4
      -1: X=0.25000000 Y=0.75000000 Z=0.75000000
      -1: X=0.75000000 Y=0.25000000 Z=0.75000000
      -1: X=0.75000000 Y=0.75000000 Z=0.25000000
Zr         NPT=  781  R0=.000010000 RMT= 2.09        Z:  40.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.75000000 Y=0.75000000 Z=0.75000000
          MULT= 4          ISPLIT= 4
      -2: X=0.75000000 Y=0.25000000 Z=0.25000000
      -2: X=0.25000000 Y=0.75000000 Z=0.25000000
      -2: X=0.25000000 Y=0.25000000 Z=0.75000000
Zr         NPT=  781  R0=.000010000 RMT= 2.09        Z:  40.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 4          ISPLIT= 4
      -3: X=0.50000000 Y=0.00000000 Z=0.50000000
      -3: X=0.50000000 Y=0.50000000 Z=0.00000000
      -3: X=0.00000000 Y=0.50000000 Z=0.50000000
Sr         NPT=  781  R0=.000010000 RMT= 2.23        Z:  38.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -4: X=0.50000000 Y=0.50000000 Z=0.50000000
          MULT= 4          ISPLIT= 4
      -4: X=0.00000000 Y=0.50000000 Z=0.00000000
      -4: X=0.00000000 Y=0.00000000 Z=0.50000000
      -4: X=0.50000000 Y=0.00000000 Z=0.00000000
Sr         NPT=  781  R0=.000010000 RMT= 2.23        Z:  38.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -5: X=0.00000000 Y=0.20500000 Z=0.20500000
          MULT=12          ISPLIT= 8
      -5: X=0.50000000 Y=0.79500000 Z=0.70500000
      -5: X=0.50000000 Y=0.29500000 Z=0.79500000
      -5: X=0.20500000 Y=0.00000000 Z=0.20500000
      -5: X=0.00000000 Y=0.70500000 Z=0.29500000
      -5: X=0.29500000 Y=0.00000000 Z=0.70500000
      -5: X=0.70500000 Y=0.50000000 Z=0.79500000
      -5: X=0.79500000 Y=0.50000000 Z=0.29500000
      -5: X=0.20500000 Y=0.20500000 Z=0.00000000
      -5: X=0.29500000 Y=0.79500000 Z=0.50000000
      -5: X=0.70500000 Y=0.29500000 Z=0.00000000
      -5: X=0.79500000 Y=0.70500000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 1.89        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=0.20500000 Y=0.20500000 Z=0.50000000
          MULT=12          ISPLIT= 8
      -6: X=0.29500000 Y=0.79500000 Z=0.00000000
      -6: X=0.70500000 Y=0.29500000 Z=0.50000000
      -6: X=0.50000000 Y=0.20500000 Z=0.20500000
      -6: X=0.79500000 Y=0.70500000 Z=0.00000000
      -6: X=0.00000000 Y=0.79500000 Z=0.70500000
      -6: X=0.00000000 Y=0.29500000 Z=0.79500000
      -6: X=0.50000000 Y=0.70500000 Z=0.29500000
      -6: X=0.20500000 Y=0.50000000 Z=0.20500000
      -6: X=0.29500000 Y=0.50000000 Z=0.70500000
      -6: X=0.70500000 Y=0.00000000 Z=0.79500000
      -6: X=0.79500000 Y=0.00000000 Z=0.29500000
O          NPT=  781  R0=.000100000 RMT= 1.89        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000