P   LATTICE,NONEQUIV.ATOMS   3  198 P213                                       
MODE OF CALC=RELA unit=bohr                                                    
 12.691401 12.691401 12.691401 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.36360000 Y=0.36360000 Z=0.36360000
          MULT= 4          ISPLIT= 4
      -1: X=0.13640000 Y=0.63640000 Z=0.86360000
      -1: X=0.86360000 Y=0.13640000 Z=0.63640000
      -1: X=0.63640000 Y=0.86360000 Z=0.13640000
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -2: X=0.65400000 Y=0.65400000 Z=0.65400000
          MULT= 4          ISPLIT= 4
      -2: X=0.84600000 Y=0.34600000 Z=0.15400000
      -2: X=0.15400000 Y=0.84600000 Z=0.34600000
      -2: X=0.34600000 Y=0.15400000 Z=0.84600000
Pt         NPT=  781  R0=.000005000 RMT= 2.40        Z:  78.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503
ATOM  -3: X=0.07930000 Y=0.07930000 Z=0.07930000
          MULT= 4          ISPLIT= 4
      -3: X=0.42070000 Y=0.92070000 Z=0.57930000
      -3: X=0.57930000 Y=0.42070000 Z=0.92070000
      -3: X=0.92070000 Y=0.57930000 Z=0.42070000
As         NPT=  781  R0=.000050000 RMT= 2.17        Z:  33.00000              
LOCAL ROT MATRIX:    0.7071068 0.4082483 0.5773503
                    -0.7071068 0.4082483 0.5773503
                     0.0000000-0.8164966 0.5773503