R   LATTICE,NONEQUIV.ATOMS   4  148 R-3                                        
MODE OF CALC=RELA unit=bohr                                                    
 11.446449 11.446449 27.932606 90.000000 90.000000120.000000                   
ATOM  -1: X=0.24900000 Y=0.24900000 Z=0.24900000
          MULT= 2          ISPLIT= 4
      -1: X=0.75100000 Y=0.75100000 Z=0.75100000
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=0.50000000 Y=0.50000000 Z=0.50000000
          MULT= 1          ISPLIT= 4
Bi         NPT=  781  R0=.000005000 RMT= 2.38        Z:  83.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 4
Sb         NPT=  781  R0=.000010000 RMT= 2.01        Z:  51.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.20020000 Y=0.26339000 Z=0.76780000
          MULT= 6          ISPLIT= 8
      -4: X=0.79980000 Y=0.73661000 Z=0.23220000
      -4: X=0.26339000 Y=0.76780000 Z=0.20020000
      -4: X=0.73661000 Y=0.23220000 Z=0.79980000
      -4: X=0.76780000 Y=0.20020000 Z=0.26339000
      -4: X=0.23220000 Y=0.79980000 Z=0.73661000
O          NPT=  781  R0=.000100000 RMT= 1.73        Z:   8.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000