B   LATTICE,NONEQUIV.ATOMS   3  204 Im-3                                       
MODE OF CALC=RELA unit=bohr                                                    
 16.410004 16.410004 16.410004 90.000000 90.000000 90.000000                   
ATOM   1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 2
Ba         NPT=  781  R0=.000010000 RMT= 2.50000     Z:  56.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -2: X=0.25000000 Y=0.25000000 Z=0.25000000
          MULT= 4          ISPLIT= 4
      -2: X=0.75000000 Y=0.75000000 Z=0.25000000
      -2: X=0.25000000 Y=0.75000000 Z=0.75000000
      -2: X=0.75000000 Y=0.25000000 Z=0.75000000
Pt         NPT=  781  R0=.000005000 RMT= 2.47        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=0.00000000 Y=0.15329000 Z=0.35660000
          MULT=12          ISPLIT= 8
      -3: X=0.00000000 Y=0.84671000 Z=0.64340000
      -3: X=0.00000000 Y=0.84671000 Z=0.35660000
      -3: X=0.00000000 Y=0.15329000 Z=0.64340000
      -3: X=0.35660000 Y=0.00000000 Z=0.15329000
      -3: X=0.64340000 Y=0.00000000 Z=0.84671000
      -3: X=0.64340000 Y=0.00000000 Z=0.15329000
      -3: X=0.35660000 Y=0.00000000 Z=0.84671000
      -3: X=0.15329000 Y=0.35660000 Z=0.00000000
      -3: X=0.84671000 Y=0.64340000 Z=0.00000000
      -3: X=0.15329000 Y=0.64340000 Z=0.00000000
      -3: X=0.84671000 Y=0.35660000 Z=0.00000000
Ge         NPT=  781  R0=.000050000 RMT= 2.24        Z:  32.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000