CXY LATTICE,NONEQUIV.ATOMS   4   64 Cmca                                       
MODE OF CALC=RELA unit=bohr                                                    
 13.537998 31.618898 13.861141 90.000000 90.000000 90.000000                   
ATOM  -1: X=0.25000000 Y=0.01430000 Z=0.25000000
          MULT= 4          ISPLIT= 8
      -1: X=0.75000000 Y=0.98570000 Z=0.75000000
      -1: X=0.25000000 Y=0.51430000 Z=0.25000000
      -1: X=0.75000000 Y=0.48570000 Z=0.75000000
Ba         NPT=  781  R0=.000010000 RMT= 2.42        Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 1.0000000 0.0000000
                     0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
ATOM  -2: X=0.00000000 Y=0.32300000 Z=0.45120000
          MULT= 4          ISPLIT= 8
      -2: X=0.00000000 Y=0.67700000 Z=0.54880000
      -2: X=0.00000000 Y=0.82300000 Z=0.04880000
      -2: X=0.00000000 Y=0.17700000 Z=0.95120000
Ba         NPT=  781  R0=.000010000 RMT= 2.42        Z:  56.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -3: X=0.00000000 Y=0.36610000 Z=0.01590000
          MULT= 4          ISPLIT= 8
      -3: X=0.00000000 Y=0.63390000 Z=0.98410000
      -3: X=0.00000000 Y=0.86610000 Z=0.48410000
      -3: X=0.00000000 Y=0.13390000 Z=0.51590000
P          NPT=  781  R0=.000100000 RMT= 2.50000     Z:  15.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000
ATOM  -4: X=0.00000000 Y=0.00000000 Z=0.00000000
          MULT= 2          ISPLIT= 8
      -4: X=0.00000000 Y=0.50000000 Z=0.50000000
O          NPT=  781  R0=.000100000 RMT= 2.42        Z:   8.00000              
LOCAL ROT MATRIX:    0.0000000 0.0000000 1.0000000
                     1.0000000 0.0000000 0.0000000
                     0.0000000 1.0000000 0.0000000