P   LATTICE,NONEQUIV.ATOMS   3  215 P-43m                                      
MODE OF CALC=RELA unit=bohr                                                    
  9.609257  9.609257  9.609257 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.15600000 Y=0.15600000 Z=0.49700000
          MULT=12          ISPLIT= 8
      -1: X=0.15600000 Y=0.84400000 Z=0.50300000
      -1: X=0.49700000 Y=0.15600000 Z=0.15600000
      -1: X=0.84400000 Y=0.84400000 Z=0.49700000
      -1: X=0.15600000 Y=0.50300000 Z=0.84400000
      -1: X=0.84400000 Y=0.15600000 Z=0.50300000
      -1: X=0.50300000 Y=0.84400000 Z=0.15600000
      -1: X=0.84400000 Y=0.49700000 Z=0.84400000
      -1: X=0.49700000 Y=0.84400000 Z=0.84400000
      -1: X=0.84400000 Y=0.50300000 Z=0.15600000
      -1: X=0.50300000 Y=0.15600000 Z=0.84400000
      -1: X=0.15600000 Y=0.49700000 Z=0.15600000
C          NPT=  781  R0=.000100000 RMT= 1.31        Z:   6.00000              
LOCAL ROT MATRIX:    0.0000000-0.7071068-0.7071068
                     0.0000000-0.7071068 0.7071068
                    -1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.24800000 Y=0.24800000 Z=0.24800000
          MULT= 4          ISPLIT= 4
      -2: X=0.24800000 Y=0.75200000 Z=0.75200000
      -2: X=0.75200000 Y=0.75200000 Z=0.24800000
      -2: X=0.75200000 Y=0.24800000 Z=0.75200000
N          NPT=  781  R0=.000100000 RMT= 1.38        Z:   7.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503
ATOM  -3: X=0.73200000 Y=0.73200000 Z=0.73200000
          MULT= 4          ISPLIT= 4
      -3: X=0.73200000 Y=0.26800000 Z=0.26800000
      -3: X=0.26800000 Y=0.26800000 Z=0.73200000
      -3: X=0.26800000 Y=0.73200000 Z=0.26800000
N          NPT=  781  R0=.000100000 RMT= 1.38        Z:   7.00000              
LOCAL ROT MATRIX:    0.4082483-0.7071068 0.5773503
                     0.4082483 0.7071068 0.5773503
                    -0.8164966 0.0000000 0.5773503