P   LATTICE,NONEQUIV.ATOMS   8    2 P-1                                        
MODE OF CALC=RELA unit=bohr                                                    
 12.484854 12.576316 12.622426 88.878000 88.846000 88.254000                   
ATOM  -1: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 1          ISPLIT= 8
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=0.41900000 Y=0.56400000 Z=0.23800000
          MULT= 2          ISPLIT= 8
      -2: X=0.58100000 Y=0.43600000 Z=0.76200000
Mo         NPT=  781  R0=.000010000 RMT= 2.41        Z:  42.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -3: X=0.56500000 Y=0.23300000 Z=0.41800000
          MULT= 2          ISPLIT= 8
      -3: X=0.43500000 Y=0.76700000 Z=0.58200000
Mo         NPT=  781  R0=.000010000 RMT= 2.41        Z:  42.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -4: X=0.23300000 Y=0.41700000 Z=0.56700000
          MULT= 2          ISPLIT= 8
      -4: X=0.76700000 Y=0.58300000 Z=0.43300000
Mo         NPT=  781  R0=.000010000 RMT= 2.41        Z:  42.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -5: X=0.73700000 Y=0.39200000 Z=0.12400000
          MULT= 2          ISPLIT= 8
      -5: X=0.26300000 Y=0.60800000 Z=0.87600000
S          NPT=  781  R0=.000100000 RMT= 2.07        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -6: X=0.25200000 Y=0.24700000 Z=0.24600000
          MULT= 2          ISPLIT= 8
      -6: X=0.74800000 Y=0.75300000 Z=0.75400000
S          NPT=  781  R0=.000100000 RMT= 2.07        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -7: X=0.12500000 Y=0.74000000 Z=0.39200000
          MULT= 2          ISPLIT= 8
      -7: X=0.87500000 Y=0.26000000 Z=0.60800000
S          NPT=  781  R0=.000100000 RMT= 2.07        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
ATOM  -8: X=0.37800000 Y=0.12200000 Z=0.73800000
          MULT= 2          ISPLIT= 8
      -8: X=0.62200000 Y=0.87800000 Z=0.26200000
S          NPT=  781  R0=.000100000 RMT= 2.07        Z:  16.00000              
LOCAL ROT MATRIX:    1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000